3-(2-methyl-1,3-benzothiazole-6-sulfonyl)-N-(2-phenylethyl)propanamide
Chemical Structure Depiction of
3-(2-methyl-1,3-benzothiazole-6-sulfonyl)-N-(2-phenylethyl)propanamide
3-(2-methyl-1,3-benzothiazole-6-sulfonyl)-N-(2-phenylethyl)propanamide
Compound characteristics
| Compound ID: | E557-3234 |
| Compound Name: | 3-(2-methyl-1,3-benzothiazole-6-sulfonyl)-N-(2-phenylethyl)propanamide |
| Molecular Weight: | 388.51 |
| Molecular Formula: | C19 H20 N2 O3 S2 |
| Smiles: | Cc1nc2ccc(cc2s1)S(CCC(NCCc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2828 |
| logD: | 2.2828 |
| logSw: | -2.9813 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.843 |
| InChI Key: | FOVMAEJNPGGUBH-UHFFFAOYSA-N |