5-ethyl-5-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Chemical Structure Depiction of
5-ethyl-5-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
5-ethyl-5-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y010-1021F |
| Compound Name: | 5-ethyl-5-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6-dihydrobenzo[h]quinazolin-4(3H)-one |
| Molecular Weight: | 312.43 |
| Molecular Formula: | C18 H20 N2 O S |
| Smiles: | CCC1(C)Cc2ccccc2C2=C1C(NC(=N2)SCC=C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2412 |
| logD: | 4.1739 |
| logSw: | -4.2661 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.63 |
| InChI Key: | NBQHXAHLXGMSKD-SFHVURJKSA-N |