3,3'-(propane-1,3-diyl)bis{2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one}
Chemical Structure Depiction of
3,3'-(propane-1,3-diyl)bis{2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one}
3,3'-(propane-1,3-diyl)bis{2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one}
Compound characteristics
Compound ID: | K284-7619 |
Compound Name: | 3,3'-(propane-1,3-diyl)bis{2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one} |
Molecular Weight: | 632.76 |
Molecular Formula: | C35 H28 N4 O4 S2 |
Smiles: | C(CN1C(=Nc2ccccc2C1=O)SCC(c1ccccc1)=O)CN1C(=Nc2ccccc2C1=O)SCC(c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 4.8511 |
logD: | 4.8511 |
logSw: | -4.8086 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 78.026 |
InChI Key: | WBJKSNGRGGFCBH-UHFFFAOYSA-N |