N-(3-chloro-4-methylphenyl)-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
N-(3-chloro-4-methylphenyl)-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | F058-0877 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 328.8 |
| Molecular Formula: | C17 H17 Cl N4 O |
| Smiles: | CC(C)n1c2ccc(cc2nn1)C(Nc1ccc(C)c(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3327 |
| logD: | 4.3246 |
| logSw: | -4.5737 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.495 |
| InChI Key: | YWFYOQQPQHBKAR-UHFFFAOYSA-N |