N-(4-cyanophenyl)-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(4-cyanophenyl)-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
N-(4-cyanophenyl)-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | F058-0914 |
| Compound Name: | N-(4-cyanophenyl)-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 305.34 |
| Molecular Formula: | C17 H15 N5 O |
| Smiles: | CC(C)n1c2ccc(cc2nn1)C(Nc1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5969 |
| logD: | 2.5831 |
| logSw: | -3.2871 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.552 |
| InChI Key: | MOAHOACRJVEQPV-UHFFFAOYSA-N |