N-{4-[4-(1,3-benzothiazol-2-yl)piperidine-1-sulfonyl]phenyl}-3-methylbenzamide
Chemical Structure Depiction of
N-{4-[4-(1,3-benzothiazol-2-yl)piperidine-1-sulfonyl]phenyl}-3-methylbenzamide
N-{4-[4-(1,3-benzothiazol-2-yl)piperidine-1-sulfonyl]phenyl}-3-methylbenzamide
Compound characteristics
| Compound ID: | D390-1334 |
| Compound Name: | N-{4-[4-(1,3-benzothiazol-2-yl)piperidine-1-sulfonyl]phenyl}-3-methylbenzamide |
| Molecular Weight: | 491.63 |
| Molecular Formula: | C26 H25 N3 O3 S2 |
| Smiles: | [H]N(C(c1cccc(C)c1)=O)c1ccc(cc1)S(N1CCC(CC1)c1nc2ccccc2s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4396 |
| logD: | 5.3798 |
| logSw: | -5.3583 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.49 |
| InChI Key: | DXTCUEHJVRKAGF-UHFFFAOYSA-N |