2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid
Modify Date: 2025-09-13 13:46:34
![2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid Structure](https://www.chemsrc.com/extcaspic/372/796594-43-9.png)
2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid structure
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Common Name | 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid | ||
|---|---|---|---|---|
| CAS Number | 796594-43-9 | Molecular Weight | 463.4 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C24H28Cl2N2O3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid |
|---|
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C24H28Cl2N2O3 |
|---|---|
| Molecular Weight | 463.4 |
| InChIKey | UMSPPMMERAOIRT-UHFFFAOYSA-N |
| SMILES | O=C(O)c1ccccc1N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1 |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Binding affinity to histamine H1 receptor
Source: ChEMBL
Target: Histamine H1 receptor
External Id: CHEMBL2160725
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Name: Displacement of 3,7-Bis[2-(4-nitro[3,5-3H]phenyl)ethyl]-3,7-diazabicyclo[3.3.1]nonane...
Source: ChEMBL
Target: Potassium voltage-gated channel subfamily H member 2
External Id: CHEMBL2160723
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Name: Binding affinity to human CCR3 expressed in CHOK1 cells by radioligand displacement a...
Source: ChEMBL
Target: C-C chemokine receptor type 3
External Id: CHEMBL2160724
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Name: ASTRAZENECA: Intrinsic clearance measured in human liver microsomes following incubat...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3301370
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Name: Oral bioavailability in rat
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL2160729
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Name: ASTRAZENECA: Second most basic pKa value (pKa B2) determined by absorption and potent...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3301373
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Name: Lipophilicity, log D of the compound at pH 7.4
Source: ChEMBL
Target: N/A
External Id: CHEMBL2160730
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Name: ASTRAZENECA: Most acidic pKa value (pKa A1) determined by absorption and potentiometr...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3301375
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Name: ASTRAZENECA: Octan-1-ol/water (pH7.4) distribution coefficent measured by a shake fl...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3301363
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This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid? |
| A: The English name of 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid is 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid. |
| Q: What is the SMILES notation of 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid? |
| A: SMILES notation of 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid is O=C(O)c1ccccc1N1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1. |
| Q: What is the molecular formula of 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid? |
| A: Molecular formula of 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid is C24H28Cl2N2O3. |
| Q: What is the molecular weight of 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid? |
| A: Molecular weight of 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid is 463.4. |
| Q: What is the CAS number of 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid? |
| A: CAS number of 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid is 796594-43-9. |
| Q: What is the Chinese name of 796594-43-9? |
| A: Chinese name of 796594-43-9 is 796594-43-9. |
| Q: What is the InChIKey of 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid? |
| A: InChIKey of 2-[4-[[4-(3,4-Dichlorophenoxy)-1-piperidinyl]methyl]-1-piperidinyl]-benzoic acid is UMSPPMMERAOIRT-UHFFFAOYSA-N. |