N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide

C23H19N3O4 — CID 39341853

IUPACN-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide
SMILESCOc1cccc(-n2cnc3cc(C(=O)Nc4ccccc4OC)ccc3c2=O)c1
InChIInChI=1S/C23H19N3O4/c1-29-17-7-5-6-16(13-17)26-14-24-20-12-15(10-11-18(20)23(26)28)22(27)25-19-8-3-4-9-21(19)30-2/h3-14H,1-2H3,(H,25,27)
InChIKeyJYFSAKBNYYQOGX-UHFFFAOYSA-N
MW401.42 g/mol
LogP3.66
Rot. Bonds5

About N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide

N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide (PubChem CID 39341853) has the molecular formula C23H19N3O4 and a molecular weight of 401.42 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide
PubChem CID39341853
Molecular FormulaC23H19N3O4
Molecular Weight401.42 g/mol
Exact Mass401.14
IUPAC NameN-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide
SMILESCOc1cccc(-n2cnc3cc(C(=O)Nc4ccccc4OC)ccc3c2=O)c1
InChIInChI=1S/C23H19N3O4/c1-29-17-7-5-6-16(13-17)26-14-24-20-12-15(10-11-18(20)23(26)28)22(27)25-19-8-3-4-9-21(19)30-2/h3-14H,1-2H3,(H,25,27)
InChIKeyJYFSAKBNYYQOGX-UHFFFAOYSA-N
XLogP3.66
TPSA82.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.42
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,4-dimethoxyphenyl)-3-(2-methoxyphenyl)-4-oxoquinazoline-7-carboxamide
CID 39342674
N-(2,5-dimethoxyphenyl)-3-(2-methoxyphenyl)-4-oxoquinazoline-7-carboxamide
CID 39331968
3-(3-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]-4-oxoquinazoline-7-carboxamide
CID 39334024
4-(4-oxoquinazolin-3-yl)-N-(2-phenoxyphenyl)benzamide
CID 39954363
methyl 3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)benzoate
CID 7749347
N-benzyl-3-(2,5-dimethoxyphenyl)-4-oxoquinazoline-7-carboxamide
CID 39313240
N-[2-methoxy-5-(methylcarbamoyl)phenyl]-3-phenylimidazo[4,5-b]pyridine-6-carboxamide
CID 176503428
N,3-bis(2-fluorophenyl)-4-oxoquinazoline-7-carboxamide
CID 39314350
3-(4-methoxyphenyl)-N-(2-methylpropyl)-4-oxoquinazoline-7-carboxamide
CID 39314202
N-(2-methoxyphenyl)-3-(4-methoxyphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide
CID 3408389
3-(2,5-dimethoxyphenyl)-N-[(4-methoxyphenyl)methyl]-4-oxoquinazoline-7-carboxamide
CID 39340542
5-N-(2-methoxyphenyl)-3-N-(3-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108873

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide (CID 39341853) is N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide is COc1cccc(-n2cnc3cc(C(=O)Nc4ccccc4OC)ccc3c2=O)c1.
What is the InChIKey of N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide?
The InChIKey is JYFSAKBNYYQOGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O4/c1-29-17-7-5-6-16(13-17)26-14-24-20-12-15(10-11-18(20)23(26)28)22(27)25-19-8-3-4-9-21(19)30-2/h3-14H,1-2H3,(H,25,27).
What are the key properties of N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide?
N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide has a molecular weight of 401.42 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-3-(3-methoxyphenyl)-4-oxoquinazoline-7-carboxamide is sourced from PubChem (CID 39341853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).