N-(3-chloro-4-methoxyphenyl)-2-(6-hydroxy-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-hydroxy-2,2-dimethyl-2,3-dihydro-4H-1-benzopyran-4-ylidene)hydrazine-1-carbothioamide
N-(3-chloro-4-methoxyphenyl)-2-(6-hydroxy-2,2-dimethyl-2,3-dihydro-4H-1-benzopyran-4-ylidene)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | K786-0945 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-(6-hydroxy-2,2-dimethyl-2,3-dihydro-4H-1-benzopyran-4-ylidene)hydrazine-1-carbothioamide |
| Molecular Weight: | 405.9 |
| Molecular Formula: | C19 H20 Cl N3 O3 S |
| Smiles: | CC1(C)C\C(c2cc(ccc2O1)O)=N/NC(Nc1ccc(c(c1)[Cl])OC)=S |
| Stereo: | ACHIRAL |
| logP: | 4.5699 |
| logD: | 4.5696 |
| logSw: | -4.4599 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 62.167 |
| InChI Key: | KBEKERUYRVYAIR-UHFFFAOYSA-N |