5-amino-N-(4-chlorophenyl)-1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(4-chlorophenyl)-1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(4-chlorophenyl)-1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | E919-0372 |
| Compound Name: | 5-amino-N-(4-chlorophenyl)-1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 430.85 |
| Molecular Formula: | C19 H19 Cl N6 O4 |
| Smiles: | COc1ccc(cc1OC)NC(Cn1c(c(C(Nc2ccc(cc2)[Cl])=O)nn1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8184 |
| logD: | 1.8181 |
| logSw: | -2.8195 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 107.698 |
| InChI Key: | VQXHNNCRNGRMJL-UHFFFAOYSA-N |