4-{[2-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
4-{[2-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(propan-2-yl)benzamide
4-{[2-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(propan-2-yl)benzamide
Compound characteristics
Compound ID: | G629-0076 |
Compound Name: | 4-{[2-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(propan-2-yl)benzamide |
Molecular Weight: | 514.65 |
Molecular Formula: | C29 H30 N4 O3 S |
Smiles: | CCc1ccccc1NC(CSC1=Nc2ccccc2C(N1Cc1ccc(cc1)C(NC(C)C)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.316 |
logD: | 4.316 |
logSw: | -4.1911 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.882 |
InChI Key: | QZEODFUSVNBAAP-UHFFFAOYSA-N |