3-[2-{[(4-chlorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
Chemical Structure Depiction of
3-[2-{[(4-chlorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
3-[2-{[(4-chlorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
Compound characteristics
Compound ID: | K284-3725 |
Compound Name: | 3-[2-{[(4-chlorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide |
Molecular Weight: | 478.01 |
Molecular Formula: | C26 H24 Cl N3 O2 S |
Smiles: | C(CN1C(=Nc2ccccc2C1=O)SCc1ccc(cc1)[Cl])C(NCCc1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 4.0021 |
logD: | 4.0021 |
logSw: | -4.6725 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.062 |
InChI Key: | LRIXOEZUTRHEPF-UHFFFAOYSA-N |