N-(2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methylbenzamide
Chemical Structure Depiction of
N-(2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methylbenzamide
N-(2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methylbenzamide
Compound characteristics
| Compound ID: | 8008-2355 |
| Compound Name: | N-(2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methylbenzamide |
| Molecular Weight: | 446.63 |
| Molecular Formula: | C26 H26 N2 O S2 |
| Smiles: | Cc1ccccc1C(Nc1ccc2c(c1)sc(n2)SCc1ccc(cc1)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4775 |
| logD: | 7.4754 |
| logSw: | -5.5735 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.139 |
| InChI Key: | OOVPYQNKCCCRAT-UHFFFAOYSA-N |