5-amino-1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-N-(2-methoxy-5-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-N-(2-methoxy-5-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-N-(2-methoxy-5-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | E919-2119 |
| Compound Name: | 5-amino-1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-N-(2-methoxy-5-methylphenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 428.88 |
| Molecular Formula: | C20 H21 Cl N6 O3 |
| Smiles: | Cc1ccc(c(c1)NC(c1c(N)n(CC(Nc2ccc(C)c(c2)[Cl])=O)nn1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1141 |
| logD: | 3.1139 |
| logSw: | -3.2167 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 99.369 |
| InChI Key: | LSMXISSHIJFDNY-UHFFFAOYSA-N |