General Information of the Compound
| Compound ID |
CP0433566
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| Compound Name |
3-Phenethyl-2-phenyl-3H-quinazolin-4-one
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| Synonyms |
2-phenyl-3-(2-phenylethyl)quinazolin-4(3H)-one
3-Phenethyl-2-phenyl-3H-quinazolin-4-one
3-Phenethyl-2-phenylquinazoline-4(3H)-one
3-phenethyl-2-phenylquinazolin-4-one
AC1LJAK1
AKOS003179499
BDBM50162540
CHEMBL180391
KANHEDFPOIQKTH-UHFFFAOYSA-N
MCULE-6975064033
MolPort-002-576-141
Oprea1_440152
SCHEMBL5777984
STL361550
ZINC546443
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| Structure |
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| Formula |
C22H18N2O
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| Molecular Weight |
326.399
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| Canonical SMILES |
O=c1n(CCc2ccccc2)c(nc2ccccc12)-c1ccccc1
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| InChI |
InChI=1S/C22H18N2O/c25-22-19-13-7-8-14-20(19)23-21(18-11-5-2-6-12-18)24(22)16-15-17-9-3-1-4-10-17/h1-14H,15-16H2
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| InChIKey |
KANHEDFPOIQKTH-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Clinical Information about the Compound