5-(((S)-2-((Tert-Butoxycarbonyl)Amino)-3-(4-Carbamoyl-2,6-Dimethylphenyl)-N-((S)-1-(5-Phenyl-1H-Imidazol-2-Yl)Ethyl)Propanamido)Methyl)-2-Methoxybenzoic Acid
Modify Date: 2025-12-11 19:19:47
5-(((S)-2-((Tert-Butoxycarbonyl)Amino)-3-(4-Carbamoyl-2,6-Dimethylphenyl)-N-((S)-1-(5-Phenyl-1H-Imidazol-2-Yl)Ethyl)Propanamido)Methyl)-2-Methoxybenzoic Acid structure
|
Common Name | 5-(((S)-2-((Tert-Butoxycarbonyl)Amino)-3-(4-Carbamoyl-2,6-Dimethylphenyl)-N-((S)-1-(5-Phenyl-1H-Imidazol-2-Yl)Ethyl)Propanamido)Methyl)-2-Methoxybenzoic Acid | ||
|---|---|---|---|---|
| CAS Number | 864825-69-4 | Molecular Weight | 669.767 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 894.5±65.0 °C at 760 mmHg | |
| Molecular Formula | C37H43N5O7 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 494.8±34.3 °C | |
| Name | 5-({(4-Carbamoyl-2,6-dimethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino}methyl)-2-methoxybenzoic acid |
|---|---|
| Synonym | More Synonyms |
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 894.5±65.0 °C at 760 mmHg |
| Molecular Formula | C37H43N5O7 |
| Molecular Weight | 669.767 |
| Flash Point | 494.8±34.3 °C |
| Exact Mass | 669.316223 |
| LogP | 6.26 |
| Vapour Pressure | 0.0±0.3 mmHg at 25°C |
| Index of Refraction | 1.608 |
| InChIKey | CVBROCMWRIDGFZ-IADCTJSHSA-N |
| SMILES | COc1ccc(CN(C(=O)C(Cc2c(C)cc(C(N)=O)cc2C)NC(=O)OC(C)(C)C)C(C)c2ncc(-c3ccccc3)[nH]2)cc1C(=O)O |
| 5-({(4-Carbamoyl-2,6-dimethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino}methyl)-2-methoxybenzoic acid |
| Benzoic acid, 5-[[[(2S)-3-[4-(aminocarbonyl)-2,6-dimethylphenyl]-2-[[(1,1-dimethylethoxy)carbonyl]amino]-1-oxopropyl][(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino]methyl]-2-methoxy- |