8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one

C23H20N2O3 — CID 102232672

IUPAC8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one
SMILESCOc1cccc(Cn2cc3cccc(-c4cccc(OC)c4)c3nc2=O)c1
InChIInChI=1S/C23H20N2O3/c1-27-19-9-3-6-16(12-19)14-25-15-18-8-5-11-21(22(18)24-23(25)26)17-7-4-10-20(13-17)28-2/h3-13,15H,14H2,1-2H3
InChIKeySZZOHKVKINKAMZ-UHFFFAOYSA-N
MW372.42 g/mol
LogP4.13
Rot. Bonds5

About 8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one

8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one (PubChem CID 102232672) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one.

Molecular Properties

Compound Name8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one
PubChem CID102232672
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one
SMILESCOc1cccc(Cn2cc3cccc(-c4cccc(OC)c4)c3nc2=O)c1
InChIInChI=1S/C23H20N2O3/c1-27-19-9-3-6-16(12-19)14-25-15-18-8-5-11-21(22(18)24-23(25)26)17-7-4-10-20(13-17)28-2/h3-13,15H,14H2,1-2H3
InChIKeySZZOHKVKINKAMZ-UHFFFAOYSA-N
XLogP4.13
TPSA53.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

8-(3-hydroxyphenyl)-3-[(3-hydroxyphenyl)methyl]quinazolin-2-one
CID 102232673
2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine
CID 132941107
1-ethyl-3-[(3-methoxyphenyl)methyl]imidazol-2-one
CID 116624332
8-methoxy-3-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methyl]pyrazolo[4,3-c]quinoline
CID 2135011
6-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]thieno[3,2-d]pyrimidin-4-one
CID 102232676
5-chloro-1-[(3-methoxyphenyl)methyl]pyrimidine-2,4-dione
CID 66425761
1-[1-benzyl-4-[3-(3-methoxyphenyl)phenyl]-2-methylpyrrol-3-yl]ethanone
CID 53493548
1-[(3-methoxyphenyl)methyl]-7-methylindole
CID 123473530
3-bromo-1-[(3-methoxyphenyl)methyl]pyridin-2-one
CID 114761033
2-[(3-methoxyphenyl)methyl]-6-(5-methyl-1H-pyrazol-4-yl)isoquinolin-1-one
CID 164572220
1-methoxy-3-[(3-methoxyphenyl)methylsulfonylmethyl]benzene
CID 20702839
2-(difluoromethyl)-7-[(3-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine
CID 95857740

Frequently Asked Questions

What is the IUPAC name of 8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one?
The IUPAC name of 8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one (CID 102232672) is 8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one.
What is the SMILES notation for 8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one?
The canonical SMILES for 8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one is COc1cccc(Cn2cc3cccc(-c4cccc(OC)c4)c3nc2=O)c1.
What is the InChIKey of 8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one?
The InChIKey is SZZOHKVKINKAMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c1-27-19-9-3-6-16(12-19)14-25-15-18-8-5-11-21(22(18)24-23(25)26)17-7-4-10-20(13-17)28-2/h3-13,15H,14H2,1-2H3.
What are the key properties of 8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one?
8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one has a molecular weight of 372.42 g/mol, XLogP of 4.13, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]quinazolin-2-one is sourced from PubChem (CID 102232672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).