N-(2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
Chemical Structure Depiction of
N-(2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
N-(2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | 8009-2945 |
| Compound Name: | N-(2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide |
| Molecular Weight: | 485.99 |
| Molecular Formula: | C23 H17 Cl F N3 O2 S2 |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSc1nc2ccc(cc2s1)NC(c1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5127 |
| logD: | 6.5075 |
| logSw: | -6.0595 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.289 |
| InChI Key: | UTAPMJXGTBNBTR-UHFFFAOYSA-N |