1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(4-bromo-2-methylphenyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(4-bromo-2-methylphenyl)piperidine-4-carboxamide
1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(4-bromo-2-methylphenyl)piperidine-4-carboxamide
Compound characteristics
Compound ID: | C361-2489 |
Compound Name: | 1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(4-bromo-2-methylphenyl)piperidine-4-carboxamide |
Molecular Weight: | 495.42 |
Molecular Formula: | C19 H19 Br N4 O3 S2 |
Smiles: | Cc1cc(ccc1NC(C1CCN(CC1)S(c1cccc2c1nsn2)(=O)=O)=O)[Br] |
Stereo: | ACHIRAL |
logP: | 3.7824 |
logD: | 3.7814 |
logSw: | -3.7882 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.296 |
InChI Key: | DAEWJJDWDMHGIG-UHFFFAOYSA-N |