N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]-3,4-dimethoxybenzamide
N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | 3864-1396 |
| Compound Name: | N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]-3,4-dimethoxybenzamide |
| Molecular Weight: | 392.39 |
| Molecular Formula: | C21 H17 F N4 O3 |
| Smiles: | COc1ccc(cc1OC)C(Nc1ccc2c(c1)nn(c1ccc(cc1)F)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9486 |
| logD: | 3.9468 |
| logSw: | -4.2358 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.625 |
| InChI Key: | TYQNINLPYZHHQV-UHFFFAOYSA-N |