2-[(4-fluorophenyl)imino]-8-methoxy-2H-1-benzopyran-3-carbothioamide
Chemical Structure Depiction of
2-[(4-fluorophenyl)imino]-8-methoxy-2H-1-benzopyran-3-carbothioamide
2-[(4-fluorophenyl)imino]-8-methoxy-2H-1-benzopyran-3-carbothioamide
Compound characteristics
| Compound ID: | C200-3022 |
| Compound Name: | 2-[(4-fluorophenyl)imino]-8-methoxy-2H-1-benzopyran-3-carbothioamide |
| Molecular Weight: | 328.36 |
| Molecular Formula: | C17 H13 F N2 O2 S |
| Smiles: | COc1cccc2C=C(/C(=N/c3ccc(cc3)F)Oc12)C(N)=S |
| Stereo: | ACHIRAL |
| logP: | 2.8244 |
| logD: | 2.8244 |
| logSw: | -3.3886 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.713 |
| InChI Key: | HWVIIYFBJACJCU-UHFFFAOYSA-N |