2-{2,2-dimethyl-6-[(2-methylphenyl)methoxy]-2,3-dihydro-4H-1-benzopyran-4-ylidene}-N-(2,4,6-trimethylphenyl)hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-{2,2-dimethyl-6-[(2-methylphenyl)methoxy]-2,3-dihydro-4H-1-benzopyran-4-ylidene}-N-(2,4,6-trimethylphenyl)hydrazine-1-carbothioamide
2-{2,2-dimethyl-6-[(2-methylphenyl)methoxy]-2,3-dihydro-4H-1-benzopyran-4-ylidene}-N-(2,4,6-trimethylphenyl)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | K788-1585 |
| Compound Name: | 2-{2,2-dimethyl-6-[(2-methylphenyl)methoxy]-2,3-dihydro-4H-1-benzopyran-4-ylidene}-N-(2,4,6-trimethylphenyl)hydrazine-1-carbothioamide |
| Molecular Weight: | 487.66 |
| Molecular Formula: | C29 H33 N3 O2 S |
| Smiles: | Cc1cc(C)c(c(C)c1)NC(N/N=C1/CC(C)(C)Oc2ccc(cc12)OCc1ccccc1C)=S |
| Stereo: | ACHIRAL |
| logP: | 7.1559 |
| logD: | 7.1335 |
| logSw: | -5.7978 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.752 |
| InChI Key: | OELSMFGDBBGEPC-UHFFFAOYSA-N |