3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]-2-{[(4-methylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]-2-{[(4-methylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]-2-{[(4-methylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y503-4624 |
| Compound Name: | 3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]-2-{[(4-methylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C24 H26 N4 O S |
| Smiles: | Cc1ccc(CSC2=Nc3ccccc3C(N2CCCn2c(C)cc(C)n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.531 |
| logD: | 3.531 |
| logSw: | -3.7472 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.735 |
| InChI Key: | ALNKGUCBSDNZEF-UHFFFAOYSA-N |