N-(2-{[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Chemical Structure Depiction of
N-(2-{[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
N-(2-{[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Compound characteristics
| Compound ID: | 8009-0077 |
| Compound Name: | N-(2-{[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C23 H19 N3 O3 S2 |
| Smiles: | COc1ccccc1NC(CSc1nc2ccc(cc2s1)NC(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7876 |
| logD: | 4.787 |
| logSw: | -4.5768 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.222 |
| InChI Key: | TWANAVBGNMNUGF-UHFFFAOYSA-N |