3-(3,3-diethoxypropyl)-2-{[(4-methylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(3,3-diethoxypropyl)-2-{[(4-methylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
3-(3,3-diethoxypropyl)-2-{[(4-methylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-4591 |
| Compound Name: | 3-(3,3-diethoxypropyl)-2-{[(4-methylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 412.55 |
| Molecular Formula: | C23 H28 N2 O3 S |
| Smiles: | CCOC(CCN1C(=Nc2ccccc2C1=O)SCc1ccc(C)cc1)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.9102 |
| logD: | 3.9102 |
| logSw: | -3.9267 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.675 |
| InChI Key: | CMADNWPXYZWWHB-UHFFFAOYSA-N |