3-(3,4-dichlorophenyl)-2-{[(4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]methyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(3,4-dichlorophenyl)-2-{[(4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]methyl}quinazolin-4(3H)-one
3-(3,4-dichlorophenyl)-2-{[(4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]methyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y010-0769 |
| Compound Name: | 3-(3,4-dichlorophenyl)-2-{[(4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]methyl}quinazolin-4(3H)-one |
| Molecular Weight: | 481.36 |
| Molecular Formula: | C23 H14 Cl2 N4 O2 S |
| Smiles: | C(C1=Nc2ccccc2C(N1c1ccc(c(c1)[Cl])[Cl])=O)SC1NC(c2ccccc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9243 |
| logD: | 3.749 |
| logSw: | -4.3941 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.128 |
| InChI Key: | CLCWUWDIUULEJN-UHFFFAOYSA-N |