5-amino-1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-N-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-N-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-N-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | E919-1591 |
| Compound Name: | 5-amino-1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-N-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 428.88 |
| Molecular Formula: | C20 H21 Cl N6 O3 |
| Smiles: | Cc1ccc(cc1[Cl])NC(Cn1c(c(C(NCc2cccc(c2)OC)=O)nn1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7675 |
| logD: | 2.7674 |
| logSw: | -3.3455 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 101.303 |
| InChI Key: | LJPCFKXYKZTZAP-UHFFFAOYSA-N |