5-amino-N-(2-chlorophenyl)-1-[2-(2-methylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(2-chlorophenyl)-1-[2-(2-methylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(2-chlorophenyl)-1-[2-(2-methylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C368-0094 |
| Compound Name: | 5-amino-N-(2-chlorophenyl)-1-[2-(2-methylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 384.82 |
| Molecular Formula: | C18 H17 Cl N6 O2 |
| Smiles: | Cc1ccccc1NC(Cn1c(c(C(Nc2ccccc2[Cl])=O)nn1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7326 |
| logD: | 1.7322 |
| logSw: | -2.4883 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 91.041 |
| InChI Key: | ZFJMGGRUNVFTNS-UHFFFAOYSA-N |