N-[(4-bromophenyl)methyl]-1-(1-methyl-1H-benzotriazole-5-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(4-bromophenyl)methyl]-1-(1-methyl-1H-benzotriazole-5-carbonyl)piperidine-4-carboxamide
N-[(4-bromophenyl)methyl]-1-(1-methyl-1H-benzotriazole-5-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F634-0351 |
| Compound Name: | N-[(4-bromophenyl)methyl]-1-(1-methyl-1H-benzotriazole-5-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 456.34 |
| Molecular Formula: | C21 H22 Br N5 O2 |
| Smiles: | Cn1c2ccc(cc2nn1)C(N1CCC(CC1)C(NCc1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8092 |
| logD: | 1.8092 |
| logSw: | -2.3474 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.284 |
| InChI Key: | XGMASATUBHNVIS-UHFFFAOYSA-N |