4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide

C24H18ClN5O2 — CID 166064088

IUPAC4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide
SMILESO=C(NCc1ccccn1)c1cn2c3ccccc3c(=O)n(Cc3ccccc3Cl)c2n1
InChIInChI=1S/C24H18ClN5O2/c25-19-10-3-1-7-16(19)14-30-23(32)18-9-2-4-11-21(18)29-15-20(28-24(29)30)22(31)27-13-17-8-5-6-12-26-17/h1-12,15H,13-14H2,(H,27,31)
InChIKeyZGYSIKNBDGLXSB-UHFFFAOYSA-N
MW443.89 g/mol
LogP3.68
Rot. Bonds5

About 4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide

4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide (PubChem CID 166064088) has the molecular formula C24H18ClN5O2 and a molecular weight of 443.89 g/mol. Its IUPAC name is 4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide.

Molecular Properties

Compound Name4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide
PubChem CID166064088
Molecular FormulaC24H18ClN5O2
Molecular Weight443.89 g/mol
Exact Mass443.11
IUPAC Name4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide
SMILESO=C(NCc1ccccn1)c1cn2c3ccccc3c(=O)n(Cc3ccccc3Cl)c2n1
InChIInChI=1S/C24H18ClN5O2/c25-19-10-3-1-7-16(19)14-30-23(32)18-9-2-4-11-21(18)29-15-20(28-24(29)30)22(31)27-13-17-8-5-6-12-26-17/h1-12,15H,13-14H2,(H,27,31)
InChIKeyZGYSIKNBDGLXSB-UHFFFAOYSA-N
XLogP3.68
TPSA81.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.89
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide 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

4-[(2-chlorophenyl)methyl]-2-(pyrrolidine-1-carbonyl)imidazo[1,2-a]quinazolin-5-one
CID 166064078
2-(2-chlorophenyl)-N-[[4-oxo-3-(pyridin-2-ylmethyl)phthalazin-1-yl]methyl]acetamide
CID 121049320
1-[(2-chlorophenyl)methyl]-N-(pyridin-2-ylmethyl)-5-pyrrol-1-yltriazole-4-carboxamide
CID 53199119
1-benzyl-N-[(2-chlorophenyl)methyl]-4-hydroxy-2-oxo-1,8-naphthyridine-3-carboxamide
CID 54727033
4-hydroxy-1-(2-methylpropyl)-2-oxo-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide
CID 54695771
2-N-[(4-chlorophenyl)methyl]-6-N-(pyridin-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109097921
N-[(2-chlorophenyl)methyl]-4-[(4-ethyl-2,3-dioxopyrido[2,3-b]pyrazin-1-yl)methyl]benzamide
CID 20933086
N-[(2-chlorophenyl)methyl]-4-[[1-[(2-fluorophenyl)methyl]-2,4-dioxoquinazolin-3-yl]methyl]benzamide
CID 22429981
2,3-dichloro-N-(pyridin-2-ylmethyl)benzamide
CID 1247422
N-[(2-chlorophenyl)methyl]isoquinoline-1-carboxamide
CID 110851409
N-[(2-chlorophenyl)methyl]-2-[2,4-dioxo-3-(pyridin-2-ylmethyl)pyrido[2,3-d]pyrimidin-8-yl]acetamide
CID 66557448
3-[(2-chlorophenyl)methyl]-2-oxo-N-(pyridin-2-ylmethyl)-1,3-benzothiazole-6-sulfonamide
CID 100754606

Frequently Asked Questions

What is the IUPAC name of 4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide?
The IUPAC name of 4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide (CID 166064088) is 4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide.
What is the SMILES notation for 4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide?
The canonical SMILES for 4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide is O=C(NCc1ccccn1)c1cn2c3ccccc3c(=O)n(Cc3ccccc3Cl)c2n1.
What is the InChIKey of 4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide?
The InChIKey is ZGYSIKNBDGLXSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18ClN5O2/c25-19-10-3-1-7-16(19)14-30-23(32)18-9-2-4-11-21(18)29-15-20(28-24(29)30)22(31)27-13-17-8-5-6-12-26-17/h1-12,15H,13-14H2,(H,27,31).
What are the key properties of 4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide?
4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide has a molecular weight of 443.89 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-chlorophenyl)methyl]-5-oxo-N-(pyridin-2-ylmethyl)imidazo[1,2-a]quinazoline-2-carboxamide is sourced from PubChem (CID 166064088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).