N-{5-[(4-ethylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-2-yl}-2-methylpropanamide
Chemical Structure Depiction of
N-{5-[(4-ethylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-2-yl}-2-methylpropanamide
N-{5-[(4-ethylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-2-yl}-2-methylpropanamide
Compound characteristics
| Compound ID: | L264-0781 |
| Compound Name: | N-{5-[(4-ethylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-2-yl}-2-methylpropanamide |
| Molecular Weight: | 403.52 |
| Molecular Formula: | C19 H21 N3 O3 S2 |
| Smiles: | [H]c1cc2c(cc1NS(c1ccc(CC)cc1)(=O)=O)nc(NC(C(C)C)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.1582 |
| logD: | 4.5753 |
| logSw: | -4.9569 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.012 |
| InChI Key: | VQEFPYYXZODJMS-UHFFFAOYSA-N |