3-[2-(cyclohex-1-en-1-yl)ethyl]-4-oxo-N-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-[2-(cyclohex-1-en-1-yl)ethyl]-4-oxo-N-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-[2-(cyclohex-1-en-1-yl)ethyl]-4-oxo-N-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K288-0412 |
| Compound Name: | 3-[2-(cyclohex-1-en-1-yl)ethyl]-4-oxo-N-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C22 H27 N3 O3 S |
| Smiles: | C1CCC(CCN2C(c3ccc(cc3NC2=S)C(NCC2CCCO2)=O)=O)=CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9816 |
| logD: | 2.9784 |
| logSw: | -3.5893 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.556 |
| InChI Key: | IHXYZCZTCZHLAD-QGZVFWFLSA-N |