3-benzyl-5,5-diethyl-2-sulfanylidene-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one
Chemical Structure Depiction of
3-benzyl-5,5-diethyl-2-sulfanylidene-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one
3-benzyl-5,5-diethyl-2-sulfanylidene-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one
Compound characteristics
| Compound ID: | 3089-0312 |
| Compound Name: | 3-benzyl-5,5-diethyl-2-sulfanylidene-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one |
| Molecular Weight: | 376.52 |
| Molecular Formula: | C23 H24 N2 O S |
| Smiles: | CCC1(CC)Cc2ccccc2C2=C1C(N(Cc1ccccc1)C(N2)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2911 |
| logD: | 5.2783 |
| logSw: | -5.1802 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.1754 |
| InChI Key: | HPSMVUKQHGMVSH-UHFFFAOYSA-N |