5-(4-Acetamidophenyl)-3-ureido-s-triazole hemihydrate
Modify Date: 2025-09-28 15:10:23
5-(4-Acetamidophenyl)-3-ureido-s-triazole hemihydrate structure
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Common Name | 5-(4-Acetamidophenyl)-3-ureido-s-triazole hemihydrate | ||
|---|---|---|---|---|
| CAS Number | 69226-78-4 | Molecular Weight | 538.51900 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C22H26N12O5 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | N-[4-[3-(carbamoylamino)-1H-1,2,4-triazol-5-yl]phenyl]acetamide,hydrate |
|---|
| Molecular Formula | C22H26N12O5 |
|---|---|
| Molecular Weight | 538.51900 |
| Exact Mass | 538.21500 |
| PSA | 269.77000 |
| LogP | 4.24970 |
| InChIKey | CIYJQKNQFURUHV-UHFFFAOYSA-N |
| SMILES | CC(=O)Nc1ccc(-c2nc(NC(N)=O)n[nH]2)cc1.CC(=O)Nc1ccc(-c2nc(NC(N)=O)n[nH]2)cc1.O |