N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-2-methoxy-3-methylbenzamide
Chemical Structure Depiction of
N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-2-methoxy-3-methylbenzamide
N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-2-methoxy-3-methylbenzamide
Compound characteristics
| Compound ID: | 8016-3597 |
| Compound Name: | N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-2-methoxy-3-methylbenzamide |
| Molecular Weight: | 375.44 |
| Molecular Formula: | C17 H14 F N3 O2 S2 |
| Smiles: | Cc1cccc(C(NC(Nc2nc3ccc(cc3s2)F)=S)=O)c1OC |
| Stereo: | ACHIRAL |
| logP: | 4.7231 |
| logD: | 4.6853 |
| logSw: | -4.7279 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.718 |
| InChI Key: | CUBPPXQEFIWHHS-UHFFFAOYSA-N |