N-(3,4-dimethylphenyl)-2-(6-hydroxy-2,2-dimethyl-2,3-dihydro-4H-1-benzopyran-4-ylidene)hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-2-(6-hydroxy-2,2-dimethyl-2,3-dihydro-4H-1-benzopyran-4-ylidene)hydrazine-1-carbothioamide
N-(3,4-dimethylphenyl)-2-(6-hydroxy-2,2-dimethyl-2,3-dihydro-4H-1-benzopyran-4-ylidene)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | K786-0190 |
| Compound Name: | N-(3,4-dimethylphenyl)-2-(6-hydroxy-2,2-dimethyl-2,3-dihydro-4H-1-benzopyran-4-ylidene)hydrazine-1-carbothioamide |
| Molecular Weight: | 369.48 |
| Molecular Formula: | C20 H23 N3 O2 S |
| Smiles: | Cc1ccc(cc1C)NC(N/N=C1\CC(C)(C)Oc2ccc(cc12)O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.0467 |
| logD: | 5.0464 |
| logSw: | -4.5561 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 54.537 |
| InChI Key: | XFLYTJSRLXESCB-UHFFFAOYSA-N |