5-amino-1-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-N-[(4-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-N-[(4-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-N-[(4-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C368-0757 |
| Compound Name: | 5-amino-1-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-N-[(4-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 416.84 |
| Molecular Formula: | C19 H18 Cl F N6 O2 |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(Cn1c(c(C(NCc2ccc(cc2)F)=O)nn1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0329 |
| logD: | 2.0328 |
| logSw: | -2.8745 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 93.061 |
| InChI Key: | OXXVKERSKBBXSM-UHFFFAOYSA-N |