3-(2-acetamido-1,3-benzothiazol-6-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-(2-acetamido-1,3-benzothiazol-6-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
3-(2-acetamido-1,3-benzothiazol-6-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | F222-0557 |
| Compound Name: | 3-(2-acetamido-1,3-benzothiazol-6-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide |
| Molecular Weight: | 399.53 |
| Molecular Formula: | C20 H21 N3 O2 S2 |
| Smiles: | CC(Nc1nc2ccc(CCC(NCc3ccc(cc3)SC)=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9508 |
| logD: | 3.9508 |
| logSw: | -4.0143 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.462 |
| InChI Key: | VEFWFTIGTKXOHB-UHFFFAOYSA-N |