N-[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)carbamoyl]-2-fluorobenzamide
Chemical Structure Depiction of
N-[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)carbamoyl]-2-fluorobenzamide
N-[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)carbamoyl]-2-fluorobenzamide
Compound characteristics
| Compound ID: | 8016-6374 |
| Compound Name: | N-[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)carbamoyl]-2-fluorobenzamide |
| Molecular Weight: | 277.26 |
| Molecular Formula: | C12 H12 F N5 O2 |
| Smiles: | Cc1nnc(C)n1NC(NC(c1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.3249 |
| logD: | -3.7172 |
| logSw: | -2.153 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.225 |
| InChI Key: | CXJHSDGJNOQMJG-UHFFFAOYSA-N |