N-(6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)propanamide
Chemical Structure Depiction of
N-(6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)propanamide
N-(6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | F690-0073 |
| Compound Name: | N-(6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)propanamide |
| Molecular Weight: | 386.49 |
| Molecular Formula: | C18 H18 N4 O2 S2 |
| Smiles: | [H]c1cc(cc2c1nc(NC(CC)=O)s2)NC(Nc1cccc(c1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7204 |
| logD: | 4.7203 |
| logSw: | -4.5126 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.452 |
| InChI Key: | KPHOMNLBNZKLCL-UHFFFAOYSA-N |