3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one

C24H23N3O3 — CID 123438581

IUPAC3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one
SMILESCOc1ccc(CNc2nc3ccc(C)cc3c(=O)n2-c2ccccc2OC)cc1
InChIInChI=1S/C24H23N3O3/c1-16-8-13-20-19(14-16)23(28)27(21-6-4-5-7-22(21)30-3)24(26-20)25-15-17-9-11-18(29-2)12-10-17/h4-14H,15H2,1-3H3,(H,25,26)
InChIKeyCADGPRVWAVIKIO-UHFFFAOYSA-N
MW401.47 g/mol
LogP4.32
Rot. Bonds6

About 3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one

3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one (PubChem CID 123438581) has the molecular formula C24H23N3O3 and a molecular weight of 401.47 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one
PubChem CID123438581
Molecular FormulaC24H23N3O3
Molecular Weight401.47 g/mol
Exact Mass401.17
IUPAC Name3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one
SMILESCOc1ccc(CNc2nc3ccc(C)cc3c(=O)n2-c2ccccc2OC)cc1
InChIInChI=1S/C24H23N3O3/c1-16-8-13-20-19(14-16)23(28)27(21-6-4-5-7-22(21)30-3)24(26-20)25-15-17-9-11-18(29-2)12-10-17/h4-14H,15H2,1-3H3,(H,25,26)
InChIKeyCADGPRVWAVIKIO-UHFFFAOYSA-N
XLogP4.32
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.47
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-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

3-(3-fluorophenyl)-6-iodo-2-[(4-methoxyphenyl)methylamino]quinazolin-4-one
CID 67982070
2-hydrazinyl-6,7-dimethoxy-3-(2-methoxyphenyl)quinazolin-4-one
CID 17221406
2-[3-(2,4-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide
CID 2385342
N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine
CID 133466915
8-methoxy-2-methylpyrido[2,1-b]quinazolin-11-one
CID 151157986
3-[(4-methoxyphenyl)methylamino]-2-(3-methylphenyl)quinazolin-4-one
CID 23907241
N-[(4-fluorophenyl)methyl]-2-[3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide
CID 35657298
2-[(3,5-difluorophenyl)methylamino]-6-(2-methoxyphenyl)-8H-pyrimido[4,5-d]pyrimidine-5,7-dione
CID 53333322
3-(2,5-dimethoxyphenyl)-2-[(3-methylphenyl)methylsulfanyl]quinazolin-4-one
CID 51365479
N-[(4-chlorophenyl)methyl]-2-[3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide
CID 4826900
3-(benzylamino)-1-(2-methoxyphenyl)pyrazin-2-one
CID 18591898
3-(2,5-dimethoxyphenyl)-2-[(2,5-dimethylphenyl)methylsulfanyl]quinazolin-4-one
CID 51365481

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one?
The IUPAC name of 3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one (CID 123438581) is 3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one.
What is the SMILES notation for 3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one?
The canonical SMILES for 3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one is COc1ccc(CNc2nc3ccc(C)cc3c(=O)n2-c2ccccc2OC)cc1.
What is the InChIKey of 3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one?
The InChIKey is CADGPRVWAVIKIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O3/c1-16-8-13-20-19(14-16)23(28)27(21-6-4-5-7-22(21)30-3)24(26-20)25-15-17-9-11-18(29-2)12-10-17/h4-14H,15H2,1-3H3,(H,25,26).
What are the key properties of 3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one?
3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one has a molecular weight of 401.47 g/mol, XLogP of 4.32, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-2-[(4-methoxyphenyl)methylamino]-6-methylquinazolin-4-one is sourced from PubChem (CID 123438581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).