N-(3-chloro-4-methoxyphenyl)-2-{6-[(4-fluorophenyl)methoxy]-2,2-dimethyl-2,3-dihydro-4H-1-benzopyran-4-ylidene}hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-{6-[(4-fluorophenyl)methoxy]-2,2-dimethyl-2,3-dihydro-4H-1-benzopyran-4-ylidene}hydrazine-1-carbothioamide
N-(3-chloro-4-methoxyphenyl)-2-{6-[(4-fluorophenyl)methoxy]-2,2-dimethyl-2,3-dihydro-4H-1-benzopyran-4-ylidene}hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | K788-2025 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-{6-[(4-fluorophenyl)methoxy]-2,2-dimethyl-2,3-dihydro-4H-1-benzopyran-4-ylidene}hydrazine-1-carbothioamide |
| Molecular Weight: | 514.02 |
| Molecular Formula: | C26 H25 Cl F N3 O3 S |
| Smiles: | CC1(C)C\C(c2cc(ccc2O1)OCc1ccc(cc1)F)=N/NC(Nc1ccc(c(c1)[Cl])OC)=S |
| Stereo: | ACHIRAL |
| logP: | 6.5345 |
| logD: | 6.5334 |
| logSw: | -6.4726 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.778 |
| InChI Key: | OAVBYVUFTZMCMS-UHFFFAOYSA-N |