3-methyl-N-(2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Chemical Structure Depiction of
3-methyl-N-(2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
3-methyl-N-(2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Compound characteristics
| Compound ID: | D336-2083 |
| Compound Name: | 3-methyl-N-(2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C24 H21 N3 O2 S2 |
| Smiles: | Cc1ccc(cc1)NC(CSc1nc2ccc(cc2s1)NC(c1cccc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.934 |
| logD: | 5.932 |
| logSw: | -5.4377 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.289 |
| InChI Key: | GKEAYJZGBZVFBJ-UHFFFAOYSA-N |