N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-2-methylbutanamide
Chemical Structure Depiction of
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-2-methylbutanamide
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-2-methylbutanamide
Compound characteristics
| Compound ID: | Y030-5642 |
| Compound Name: | N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-2-methylbutanamide |
| Molecular Weight: | 312.41 |
| Molecular Formula: | C13 H16 N2 O3 S2 |
| Smiles: | CCC(C)C(Nc1nc2ccc(cc2s1)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3822 |
| logD: | 2.3818 |
| logSw: | -3.0414 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.111 |
| InChI Key: | CAHDAIQLPLVTBB-QMMMGPOBSA-N |