N-[(4-methylphenyl)methyl]-1-(1-propyl-1H-benzotriazole-5-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-1-(1-propyl-1H-benzotriazole-5-sulfonyl)piperidine-3-carboxamide
N-[(4-methylphenyl)methyl]-1-(1-propyl-1H-benzotriazole-5-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F856-0035 |
| Compound Name: | N-[(4-methylphenyl)methyl]-1-(1-propyl-1H-benzotriazole-5-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C23 H29 N5 O3 S |
| Smiles: | CCCn1c2ccc(cc2nn1)S(N1CCCC(C1)C(NCc1ccc(C)cc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7016 |
| logD: | 2.7016 |
| logSw: | -3.1782 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.972 |
| InChI Key: | VLQWUYIHGWQKQU-IBGZPJMESA-N |