5-amino-N-(5-chloro-2-methylphenyl)-1-[(4-methylphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(5-chloro-2-methylphenyl)-1-[(4-methylphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(5-chloro-2-methylphenyl)-1-[(4-methylphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C549-0044 |
| Compound Name: | 5-amino-N-(5-chloro-2-methylphenyl)-1-[(4-methylphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 355.83 |
| Molecular Formula: | C18 H18 Cl N5 O |
| Smiles: | Cc1ccc(Cn2c(c(C(Nc3cc(ccc3C)[Cl])=O)nn2)N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1457 |
| logD: | 3.1451 |
| logSw: | -3.3874 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.59 |
| InChI Key: | XNEIEVFTMVRGBQ-UHFFFAOYSA-N |