4-{[2-{[(4-chlorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
4-{[2-{[(4-chlorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(propan-2-yl)benzamide
4-{[2-{[(4-chlorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(propan-2-yl)benzamide
Compound characteristics
Compound ID: | G629-0059 |
Compound Name: | 4-{[2-{[(4-chlorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(propan-2-yl)benzamide |
Molecular Weight: | 478.01 |
Molecular Formula: | C26 H24 Cl N3 O2 S |
Smiles: | CC(C)NC(c1ccc(CN2C(=Nc3ccccc3C2=O)SCc2ccc(cc2)[Cl])cc1)=O |
Stereo: | ACHIRAL |
logP: | 4.7357 |
logD: | 4.7357 |
logSw: | -4.8507 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.43 |
InChI Key: | AZJNMIKUPVXCIP-UHFFFAOYSA-N |