ethyl 4-[(1-phenyl-1H-1,2,4-triazole-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(1-phenyl-1H-1,2,4-triazole-3-carbonyl)amino]benzoate
ethyl 4-[(1-phenyl-1H-1,2,4-triazole-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | C301-4130 |
| Compound Name: | ethyl 4-[(1-phenyl-1H-1,2,4-triazole-3-carbonyl)amino]benzoate |
| Molecular Weight: | 336.35 |
| Molecular Formula: | C18 H16 N4 O3 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1ncn(c2ccccc2)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2985 |
| logD: | 3.2982 |
| logSw: | -3.5218 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.023 |
| InChI Key: | YWSIYUVMCBMCPK-UHFFFAOYSA-N |