1-[1-(butan-2-yl)-1H-benzotriazole-5-sulfonyl]-N-(4-chloro-2-fluorophenyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-[1-(butan-2-yl)-1H-benzotriazole-5-sulfonyl]-N-(4-chloro-2-fluorophenyl)piperidine-4-carboxamide
1-[1-(butan-2-yl)-1H-benzotriazole-5-sulfonyl]-N-(4-chloro-2-fluorophenyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F855-0082 |
| Compound Name: | 1-[1-(butan-2-yl)-1H-benzotriazole-5-sulfonyl]-N-(4-chloro-2-fluorophenyl)piperidine-4-carboxamide |
| Molecular Weight: | 493.99 |
| Molecular Formula: | C22 H25 Cl F N5 O3 S |
| Smiles: | CCC(C)n1c2ccc(cc2nn1)S(N1CCC(CC1)C(Nc1ccc(cc1F)[Cl])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0312 |
| logD: | 3.9892 |
| logSw: | -4.3641 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.093 |
| InChI Key: | OAXZKOPMNGDMGP-AWEZNQCLSA-N |