3-benzyl-5,5-dimethyl-2-(methylsulfanyl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Chemical Structure Depiction of
3-benzyl-5,5-dimethyl-2-(methylsulfanyl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
3-benzyl-5,5-dimethyl-2-(methylsulfanyl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 8009-6651 |
| Compound Name: | 3-benzyl-5,5-dimethyl-2-(methylsulfanyl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one |
| Molecular Weight: | 362.49 |
| Molecular Formula: | C22 H22 N2 O S |
| Smiles: | CC1(C)Cc2ccccc2C2=C1C(N(Cc1ccccc1)C(=N2)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2796 |
| logD: | 5.2792 |
| logSw: | -5.195 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.9001 |
| InChI Key: | VRJVQLFXTQPDQT-UHFFFAOYSA-N |