5-amino-N-(2-methoxyphenyl)-3-{[(2-methoxyphenyl)carbamamido]methyl}-1H-1,2,4-triazole-1-carboxamide
Chemical Structure Depiction of
5-amino-N-(2-methoxyphenyl)-3-{[(2-methoxyphenyl)carbamamido]methyl}-1H-1,2,4-triazole-1-carboxamide
5-amino-N-(2-methoxyphenyl)-3-{[(2-methoxyphenyl)carbamamido]methyl}-1H-1,2,4-triazole-1-carboxamide
Compound characteristics
| Compound ID: | C908-0182 |
| Compound Name: | 5-amino-N-(2-methoxyphenyl)-3-{[(2-methoxyphenyl)carbamamido]methyl}-1H-1,2,4-triazole-1-carboxamide |
| Molecular Weight: | 411.42 |
| Molecular Formula: | C19 H21 N7 O4 |
| Smiles: | COc1ccccc1NC(NCc1nc(N)n(C(Nc2ccccc2OC)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7899 |
| logD: | 1.7898 |
| logSw: | -2.1545 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 115.42 |
| InChI Key: | KPJQQNCTUBPHJL-UHFFFAOYSA-N |