2-[6-hydroxy-2-methyl-2-(pyridin-3-yl)-2,3-dihydro-4H-1-benzopyran-4-ylidene]-N-(4-methoxyphenyl)hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-[6-hydroxy-2-methyl-2-(pyridin-3-yl)-2,3-dihydro-4H-1-benzopyran-4-ylidene]-N-(4-methoxyphenyl)hydrazine-1-carbothioamide
2-[6-hydroxy-2-methyl-2-(pyridin-3-yl)-2,3-dihydro-4H-1-benzopyran-4-ylidene]-N-(4-methoxyphenyl)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | K786-1888 |
| Compound Name: | 2-[6-hydroxy-2-methyl-2-(pyridin-3-yl)-2,3-dihydro-4H-1-benzopyran-4-ylidene]-N-(4-methoxyphenyl)hydrazine-1-carbothioamide |
| Molecular Weight: | 434.52 |
| Molecular Formula: | C23 H22 N4 O3 S |
| Smiles: | CC1(C\C(c2cc(ccc2O1)O)=N/NC(Nc1ccc(cc1)OC)=S)c1cccnc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1051 |
| logD: | 4.1049 |
| logSw: | -4.2103 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.279 |
| InChI Key: | JSMLRVCHZXAMAO-QHCPKHFHSA-N |