5-amino-N-(5-chloro-2-methoxyphenyl)-1-[2-(2-fluoroanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(5-chloro-2-methoxyphenyl)-1-[2-(2-fluoroanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(5-chloro-2-methoxyphenyl)-1-[2-(2-fluoroanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C368-0206 |
| Compound Name: | 5-amino-N-(5-chloro-2-methoxyphenyl)-1-[2-(2-fluoroanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 418.81 |
| Molecular Formula: | C18 H16 Cl F N6 O3 |
| Smiles: | COc1ccc(cc1NC(c1c(N)n(CC(Nc2ccccc2F)=O)nn1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.92 |
| logD: | 1.9109 |
| logSw: | -2.9976 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 98.672 |
| InChI Key: | HOXLBFIIDGSPGC-UHFFFAOYSA-N |