4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide

C30H23N5O2 — CID 46813436

IUPAC4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
SMILESCc1cccn2c(NC(=O)c3ccc(-n4c(C)nc5ccccc5c4=O)cc3)c(-c3ccccc3)nc12
InChIInChI=1S/C30H23N5O2/c1-19-9-8-18-34-27(19)32-26(21-10-4-3-5-11-21)28(34)33-29(36)22-14-16-23(17-15-22)35-20(2)31-25-13-7-6-12-24(25)30(35)37/h3-18H,1-2H3,(H,33,36)
InChIKeyDBELQFBVWAWBCY-UHFFFAOYSA-N
MW485.55 g/mol
LogP5.57
Rot. Bonds4

About 4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide

4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide (PubChem CID 46813436) has the molecular formula C30H23N5O2 and a molecular weight of 485.55 g/mol. Its IUPAC name is 4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide.

Molecular Properties

Compound Name4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
PubChem CID46813436
Molecular FormulaC30H23N5O2
Molecular Weight485.55 g/mol
Exact Mass485.19
IUPAC Name4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
SMILESCc1cccn2c(NC(=O)c3ccc(-n4c(C)nc5ccccc5c4=O)cc3)c(-c3ccccc3)nc12
InChIInChI=1S/C30H23N5O2/c1-19-9-8-18-34-27(19)32-26(21-10-4-3-5-11-21)28(34)33-29(36)22-14-16-23(17-15-22)35-20(2)31-25-13-7-6-12-24(25)30(35)37/h3-18H,1-2H3,(H,33,36)
InChIKeyDBELQFBVWAWBCY-UHFFFAOYSA-N
XLogP5.57
TPSA81.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500485.55
LogP ≤ 55.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrazol-1-ylbenzamide
CID 55369681
4-methyl-N-[4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]benzamide
CID 7294843
N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide
CID 39795631
2-[[4-(2-methyl-4-oxoquinazolin-3-yl)benzoyl]amino]benzamide
CID 9399217
N-(3-iodo-4-methylphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide
CID 46809727
4-(2-methyl-4-oxoquinazolin-3-yl)-N-[4-(2-methylpropanoylamino)phenyl]benzamide
CID 39777242
4-(2-methyl-4-oxoquinazolin-3-yl)-N-[4-(trifluoromethyl)phenyl]benzamide
CID 39776766
4-(2-methyl-4-oxoquinazolin-3-yl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide
CID 32624561
4-(2-methyl-4-oxoquinazolin-3-yl)-N-(2-piperidin-1-ylphenyl)benzamide
CID 43027483
5-methyl-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-1,2-oxazole-3-carboxamide
CID 60520237
N-[5-[3-(4-acetylphenyl)-4-oxoquinazolin-2-yl]-4-phenyl-1,3-thiazol-2-yl]-4-methylbenzamide
CID 87663735
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide
CID 55661317

Frequently Asked Questions

What is the IUPAC name of 4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide?
The IUPAC name of 4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide (CID 46813436) is 4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide.
What is the SMILES notation for 4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide?
The canonical SMILES for 4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide is Cc1cccn2c(NC(=O)c3ccc(-n4c(C)nc5ccccc5c4=O)cc3)c(-c3ccccc3)nc12.
What is the InChIKey of 4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide?
The InChIKey is DBELQFBVWAWBCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H23N5O2/c1-19-9-8-18-34-27(19)32-26(21-10-4-3-5-11-21)28(34)33-29(36)22-14-16-23(17-15-22)35-20(2)31-25-13-7-6-12-24(25)30(35)37/h3-18H,1-2H3,(H,33,36).
What are the key properties of 4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide?
4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide has a molecular weight of 485.55 g/mol, XLogP of 5.57, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide is sourced from PubChem (CID 46813436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).