N-(2-{[(2,4,6-trimethylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide
Chemical Structure Depiction of
N-(2-{[(2,4,6-trimethylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide
N-(2-{[(2,4,6-trimethylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide
Compound characteristics
| Compound ID: | 3614-0094 |
| Compound Name: | N-(2-{[(2,4,6-trimethylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide |
| Molecular Weight: | 356.51 |
| Molecular Formula: | C19 H20 N2 O S2 |
| Smiles: | CC(Nc1ccc2c(c1)sc(n2)SCc1c(C)cc(C)cc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7548 |
| logD: | 5.7548 |
| logSw: | -5.387 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.31 |
| InChI Key: | PVHYDOOPOQWOBC-UHFFFAOYSA-N |