8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one

C20H16ClN3O — CID 118631145

IUPAC8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one
SMILESCc1cc(=O)n2cc(-c3ccc(Cl)cc3)nc2n1Cc1ccccc1
InChIInChI=1S/C20H16ClN3O/c1-14-11-19(25)24-13-18(16-7-9-17(21)10-8-16)22-20(24)23(14)12-15-5-3-2-4-6-15/h2-11,13H,12H2,1H3
InChIKeyZVTAGZNKWZEYEJ-UHFFFAOYSA-N
MW349.82 g/mol
LogP4.17
Rot. Bonds3

About 8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one

8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one (PubChem CID 118631145) has the molecular formula C20H16ClN3O and a molecular weight of 349.82 g/mol. Its IUPAC name is 8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one
PubChem CID118631145
Molecular FormulaC20H16ClN3O
Molecular Weight349.82 g/mol
Exact Mass349.10
IUPAC Name8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one
SMILESCc1cc(=O)n2cc(-c3ccc(Cl)cc3)nc2n1Cc1ccccc1
InChIInChI=1S/C20H16ClN3O/c1-14-11-19(25)24-13-18(16-7-9-17(21)10-8-16)22-20(24)23(14)12-15-5-3-2-4-6-15/h2-11,13H,12H2,1H3
InChIKeyZVTAGZNKWZEYEJ-UHFFFAOYSA-N
XLogP4.17
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.82
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Saripidem
CID 3058746
1-(4-Chlorobenzyl)-5-phenyl-1H-imidazole
CID 45103809
(1-Benzyl-1h-Imidazol-4-Yl)[4-(2-Chlorophenyl)piperazin-1-Yl]methanone
CID 74983356
2-(4-Chlorophenyl)-7-methyl-8-pentylimidazo[1,2-a]pyrimidin-5-one
CID 77846095
Ethyl 2-[2-(4-chlorophenyl)-7-methyl-5-oxoimidazo[1,2-a]pyrimidin-8-yl]acetate
CID 118631140
1-(4-chlorobenzyl)-3-(4-chlorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium chloride
CID 16682378
4-[(1-{[5-(3-chlorophenyl)-8-methyl-7-oxo-7,8-dihydro-1,8-naphthyridin-3-yl]methyl}-1H-imidazol-5-yl)methyl]benzonitrile
CID 23646766
2-[5-(4-Chlorophenyl)-1-prop-2-enylimidazol-2-yl]sulfanylpropanamide
CID 4779876
2-[2-(4-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide
CID 10452566
N,N-dibutyl-2-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
CID 10572917
7-Methyl-2-phenylimidazo[1,2-a]pyrimidin-5-ol
CID 2763440
1-(3-Chlorophenyl)-4-[[3-[[4-(4-chlorophenyl)phenyl]methyl]imidazol-4-yl]methyl]piperazin-2-one
CID 9848457

Frequently Asked Questions

What is the IUPAC name of 8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one?
The IUPAC name of 8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one (CID 118631145) is 8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one.
What is the SMILES notation for 8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one?
The canonical SMILES for 8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one is Cc1cc(=O)n2cc(-c3ccc(Cl)cc3)nc2n1Cc1ccccc1.
What is the InChIKey of 8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one?
The InChIKey is ZVTAGZNKWZEYEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClN3O/c1-14-11-19(25)24-13-18(16-7-9-17(21)10-8-16)22-20(24)23(14)12-15-5-3-2-4-6-15/h2-11,13H,12H2,1H3.
What are the key properties of 8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one?
8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one has a molecular weight of 349.82 g/mol, XLogP of 4.17, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-benzyl-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-one is sourced from PubChem (CID 118631145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).