N-{4-[4-(1,3-benzothiazol-2-yl)piperidine-1-sulfonyl]phenyl}-3-methylbutanamide
Chemical Structure Depiction of
N-{4-[4-(1,3-benzothiazol-2-yl)piperidine-1-sulfonyl]phenyl}-3-methylbutanamide
N-{4-[4-(1,3-benzothiazol-2-yl)piperidine-1-sulfonyl]phenyl}-3-methylbutanamide
Compound characteristics
Compound ID: | D390-1394 |
Compound Name: | N-{4-[4-(1,3-benzothiazol-2-yl)piperidine-1-sulfonyl]phenyl}-3-methylbutanamide |
Molecular Weight: | 457.61 |
Molecular Formula: | C23 H27 N3 O3 S2 |
Smiles: | [H]N(C(CC(C)C)=O)c1ccc(cc1)S(N1CCC(CC1)c1nc2ccccc2s1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.8667 |
logD: | 4.8653 |
logSw: | -4.4429 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.548 |
InChI Key: | GYWNWBCZBJZNAW-UHFFFAOYSA-N |