N-{6-[(3-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-2-yl}propanamide
Chemical Structure Depiction of
N-{6-[(3-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-2-yl}propanamide
N-{6-[(3-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-2-yl}propanamide
Compound characteristics
| Compound ID: | F689-0075 |
| Compound Name: | N-{6-[(3-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-2-yl}propanamide |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C17 H17 N3 O3 S2 |
| Smiles: | [H]c1cc(cc2c1nc(NC(CC)=O)s2)NS(c1cccc(C)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8496 |
| logD: | 3.6559 |
| logSw: | -3.8246 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.799 |
| InChI Key: | LBGBAEANDQAUDL-UHFFFAOYSA-N |