N-(2-{[(4-tert-butyl-2,6-dimethylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
Chemical Structure Depiction of
N-(2-{[(4-tert-butyl-2,6-dimethylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
N-(2-{[(4-tert-butyl-2,6-dimethylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | 8010-2880 |
| Compound Name: | N-(2-{[(4-tert-butyl-2,6-dimethylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide |
| Molecular Weight: | 478.65 |
| Molecular Formula: | C27 H27 F N2 O S2 |
| Smiles: | Cc1cc(cc(C)c1CSc1nc2ccc(cc2s1)NC(c1ccccc1F)=O)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 8.3704 |
| logD: | 8.3652 |
| logSw: | -5.6954 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.139 |
| InChI Key: | SORUCWUFQYOWMX-UHFFFAOYSA-N |