5-amino-1-[2-(2-fluoroanilino)-2-oxoethyl]-N-(2-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[2-(2-fluoroanilino)-2-oxoethyl]-N-(2-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[2-(2-fluoroanilino)-2-oxoethyl]-N-(2-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C368-0200 |
| Compound Name: | 5-amino-1-[2-(2-fluoroanilino)-2-oxoethyl]-N-(2-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 384.37 |
| Molecular Formula: | C18 H17 F N6 O3 |
| Smiles: | COc1ccccc1NC(c1c(N)n(CC(Nc2ccccc2F)=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4202 |
| logD: | 1.4201 |
| logSw: | -2.1535 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 98.672 |
| InChI Key: | PXCIYWMMPMQXIH-UHFFFAOYSA-N |