5-amino-N-(3-chloro-4-fluorophenyl)-1-{[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(3-chloro-4-fluorophenyl)-1-{[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(3-chloro-4-fluorophenyl)-1-{[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L937-0227 |
| Compound Name: | 5-amino-N-(3-chloro-4-fluorophenyl)-1-{[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 456.86 |
| Molecular Formula: | C21 H18 Cl F N6 O3 |
| Smiles: | Cc1c(Cn2c(c(C(Nc3ccc(c(c3)[Cl])F)=O)nn2)N)nc(c2ccccc2OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.1013 |
| logD: | 3.0812 |
| logSw: | -3.5974 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.04 |
| InChI Key: | MHYMARKLBXQNMA-UHFFFAOYSA-N |