N-(4-methoxy-6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)acetamide
Chemical Structure Depiction of
N-(4-methoxy-6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)acetamide
N-(4-methoxy-6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | F690-0750 |
| Compound Name: | N-(4-methoxy-6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)acetamide |
| Molecular Weight: | 402.49 |
| Molecular Formula: | C18 H18 N4 O3 S2 |
| Smiles: | CC(Nc1nc2c(cc(cc2s1)NC(Nc1cccc(c1)SC)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1747 |
| logD: | 4.1747 |
| logSw: | -4.3711 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.965 |
| InChI Key: | DKUILLQYCFSLEK-UHFFFAOYSA-N |