3-benzyl-5-cyclohexyl-5-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Chemical Structure Depiction of
3-benzyl-5-cyclohexyl-5-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
3-benzyl-5-cyclohexyl-5-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 4121-0075 |
| Compound Name: | 3-benzyl-5-cyclohexyl-5-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6-dihydrobenzo[h]quinazolin-4(3H)-one |
| Molecular Weight: | 456.65 |
| Molecular Formula: | C29 H32 N2 O S |
| Smiles: | CC1(Cc2ccccc2C2=C1C(N(Cc1ccccc1)C(=N2)SCC=C)=O)C1CCCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.5651 |
| logD: | 7.5651 |
| logSw: | -5.6147 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.8207 |
| InChI Key: | DHKHUOLIHHJKOX-LJAQVGFWSA-N |