5-amino-1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C200-1425 |
| Compound Name: | 5-amino-1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 444.88 |
| Molecular Formula: | C20 H21 Cl N6 O4 |
| Smiles: | COc1ccccc1CNC(c1c(N)n(CC(Nc2ccc(c(c2)[Cl])OC)=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0119 |
| logD: | 2.0117 |
| logSw: | -2.9109 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 109.02 |
| InChI Key: | JIEMQXUMNMXULI-UHFFFAOYSA-N |