2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide

C24H21N3O4 — CID 17147912

IUPAC2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(NC(=O)Cn2c(=O)n(-c3ccccc3)c(=O)c3ccccc32)cc1
InChIInChI=1S/C24H21N3O4/c1-2-31-19-14-12-17(13-15-19)25-22(28)16-26-21-11-7-6-10-20(21)23(29)27(24(26)30)18-8-4-3-5-9-18/h3-15H,2,16H2,1H3,(H,25,28)
InChIKeyIXIVLRLFQPMZQW-UHFFFAOYSA-N
MW415.45 g/mol
LogP3.19
Rot. Bonds6

About 2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide

2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide (PubChem CID 17147912) has the molecular formula C24H21N3O4 and a molecular weight of 415.45 g/mol. Its IUPAC name is 2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide
PubChem CID17147912
Molecular FormulaC24H21N3O4
Molecular Weight415.45 g/mol
Exact Mass415.15
IUPAC Name2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(NC(=O)Cn2c(=O)n(-c3ccccc3)c(=O)c3ccccc32)cc1
InChIInChI=1S/C24H21N3O4/c1-2-31-19-14-12-17(13-15-19)25-22(28)16-26-21-11-7-6-10-20(21)23(29)27(24(26)30)18-8-4-3-5-9-18/h3-15H,2,16H2,1H3,(H,25,28)
InChIKeyIXIVLRLFQPMZQW-UHFFFAOYSA-N
XLogP3.19
TPSA82.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.45
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-methylphenyl)-2-[3-(4-methylphenyl)-2,4-dioxoquinazolin-1-yl]acetamide
CID 22429419
2-[3-(4-chlorophenyl)-2,4-dioxoquinazolin-1-yl]-N-(4-methoxyphenyl)acetamide
CID 17027583
2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(2-methylphenyl)acetamide
CID 17147914
N-(4-ethoxyphenyl)-2-(4-oxo-3-prop-2-enyl-2-sulfanylidenequinazolin-1-yl)acetamide
CID 4750859
2-[4-[1-(2-anilino-2-oxoethyl)-2,4-dioxoquinazolin-3-yl]phenyl]-N-(2-methoxyethyl)acetamide
CID 50762552
2-[3-(2-chlorophenyl)-2,4-dioxoquinazolin-1-yl]-N-(4-methoxyphenyl)acetamide
CID 42811337
methyl 4-[[2-[3-[4-[2-(methylamino)-2-oxoethyl]phenyl]-2,4-dioxoquinazolin-1-yl]acetyl]amino]benzoate
CID 50763335
N-(4-methoxyphenyl)-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide
CID 6502403
methyl 4-[[2-(4-oxo-3-phenyl-2-sulfanylidenequinazolin-1-yl)acetyl]amino]benzoate
CID 163322958
2-[2,4-dioxo-3-(2-phenylethyl)thieno[3,2-d]pyrimidin-1-yl]-N-(4-ethoxyphenyl)acetamide
CID 6486464
N-[(2-chlorophenyl)methyl]-4-[1-[2-(4-ethoxyanilino)-2-oxoethyl]-2,4-dioxoquinazolin-3-yl]butanamide
CID 22429763
N-(4-ethoxyphenyl)-2-(2-oxo-3H-benzimidazol-1-yl)acetamide
CID 113195260

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide?
The IUPAC name of 2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide (CID 17147912) is 2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide is CCOc1ccc(NC(=O)Cn2c(=O)n(-c3ccccc3)c(=O)c3ccccc32)cc1.
What is the InChIKey of 2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide?
The InChIKey is IXIVLRLFQPMZQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O4/c1-2-31-19-14-12-17(13-15-19)25-22(28)16-26-21-11-7-6-10-20(21)23(29)27(24(26)30)18-8-4-3-5-9-18/h3-15H,2,16H2,1H3,(H,25,28).
What are the key properties of 2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide?
2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide has a molecular weight of 415.45 g/mol, XLogP of 3.19, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxo-3-phenylquinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide is sourced from PubChem (CID 17147912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).