N-(2-{[(3-acetyl-2,4,6-trimethylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
Chemical Structure Depiction of
N-(2-{[(3-acetyl-2,4,6-trimethylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
N-(2-{[(3-acetyl-2,4,6-trimethylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
Compound characteristics
| Compound ID: | 3614-0190 |
| Compound Name: | N-(2-{[(3-acetyl-2,4,6-trimethylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide |
| Molecular Weight: | 412.57 |
| Molecular Formula: | C22 H24 N2 O2 S2 |
| Smiles: | CCC(Nc1ccc2c(c1)sc(n2)SCc1c(C)cc(C)c(C(C)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7962 |
| logD: | 5.7961 |
| logSw: | -5.5201 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.024 |
| InChI Key: | MZDHFEVWRNPUAL-UHFFFAOYSA-N |