3-[2-(cyclohex-1-en-1-yl)ethyl]-N-(2,3-dimethylcyclohexyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-[2-(cyclohex-1-en-1-yl)ethyl]-N-(2,3-dimethylcyclohexyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-[2-(cyclohex-1-en-1-yl)ethyl]-N-(2,3-dimethylcyclohexyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K288-0587 |
| Compound Name: | 3-[2-(cyclohex-1-en-1-yl)ethyl]-N-(2,3-dimethylcyclohexyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 439.62 |
| Molecular Formula: | C25 H33 N3 O2 S |
| Smiles: | CC1CCCC(C1C)NC(c1ccc2C(N(CCC3CCCCC=3)C(Nc2c1)=S)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8562 |
| logD: | 4.8529 |
| logSw: | -4.4785 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.017 |
| InChI Key: | QLDOTHZPOOJCTO-UHFFFAOYSA-N |