4,4-dimethyl-6-oxo-N-phenyl-2-[(2-phenylethyl)amino]cyclohex-1-ene-1-carbothioamide
Chemical Structure Depiction of
4,4-dimethyl-6-oxo-N-phenyl-2-[(2-phenylethyl)amino]cyclohex-1-ene-1-carbothioamide
4,4-dimethyl-6-oxo-N-phenyl-2-[(2-phenylethyl)amino]cyclohex-1-ene-1-carbothioamide
Compound characteristics
| Compound ID: | 4038-0084 |
| Compound Name: | 4,4-dimethyl-6-oxo-N-phenyl-2-[(2-phenylethyl)amino]cyclohex-1-ene-1-carbothioamide |
| Molecular Weight: | 378.54 |
| Molecular Formula: | C23 H26 N2 O S |
| Smiles: | CC1(C)CC(=C(C(C1)=O)C(Nc1ccccc1)=S)NCCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4444 |
| logD: | 4.4214 |
| logSw: | -4.3917 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 33.045 |
| InChI Key: | JDONCFHNIWSANY-UHFFFAOYSA-N |