N-(2-{[2-(2,6-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
Chemical Structure Depiction of
N-(2-{[2-(2,6-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
N-(2-{[2-(2,6-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | 8008-8650 |
| Compound Name: | N-(2-{[2-(2,6-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide |
| Molecular Weight: | 465.57 |
| Molecular Formula: | C24 H20 F N3 O2 S2 |
| Smiles: | Cc1cccc(C)c1NC(CSc1nc2ccc(cc2s1)NC(c1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3072 |
| logD: | 5.302 |
| logSw: | -5.2706 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.893 |
| InChI Key: | NSLJHSDDSHLNFO-UHFFFAOYSA-N |