5-amino-N-(5-chloro-2-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(5-chloro-2-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(5-chloro-2-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C549-0346 |
| Compound Name: | 5-amino-N-(5-chloro-2-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 387.82 |
| Molecular Formula: | C18 H18 Cl N5 O3 |
| Smiles: | COc1cccc(Cn2c(c(C(Nc3cc(ccc3OC)[Cl])=O)nn2)N)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.5734 |
| logD: | 2.5643 |
| logSw: | -3.3804 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 83.764 |
| InChI Key: | PETABCGTHAVCGD-UHFFFAOYSA-N |