7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione

C25H18N2O2 — CID 175627260

IUPAC7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione
SMILESCc1ccccc1-c1ccc2c(=O)n(-c3cccc4ccccc34)c(=O)[nH]c2c1
InChIInChI=1S/C25H18N2O2/c1-16-7-2-4-10-19(16)18-13-14-21-22(15-18)26-25(29)27(24(21)28)23-12-6-9-17-8-3-5-11-20(17)23/h2-15H,1H3,(H,26,29)
InChIKeyAUCWZFBMSAPAEA-UHFFFAOYSA-N
MW378.43 g/mol
LogP4.81
Rot. Bonds2

About 7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione

7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione (PubChem CID 175627260) has the molecular formula C25H18N2O2 and a molecular weight of 378.43 g/mol. Its IUPAC name is 7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione.

Molecular Properties

Compound Name7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione
PubChem CID175627260
Molecular FormulaC25H18N2O2
Molecular Weight378.43 g/mol
Exact Mass378.14
IUPAC Name7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione
SMILESCc1ccccc1-c1ccc2c(=O)n(-c3cccc4ccccc34)c(=O)[nH]c2c1
InChIInChI=1S/C25H18N2O2/c1-16-7-2-4-10-19(16)18-13-14-21-22(15-18)26-25(29)27(24(21)28)23-12-6-9-17-8-3-5-11-20(17)23/h2-15H,1H3,(H,26,29)
InChIKeyAUCWZFBMSAPAEA-UHFFFAOYSA-N
XLogP4.81
TPSA54.86 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.43
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-[2-(2-chlorophenyl)phenyl]-3-naphthalen-1-yl-1H-quinazoline-2,4-dione
CID 175627336
7-[2-(difluoromethyl)phenyl]-3-naphthalen-1-yl-1H-quinazoline-2,4-dione
CID 175627281
7-(2,6-dichlorophenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione
CID 175627384
3-naphthalen-1-yl-1H-quinazoline-2,4-dione
CID 11266204
3-(3-naphthalen-1-yl-2,4-dioxo-1H-quinazolin-7-yl)benzonitrile
CID 175627262
7-[2-chloro-6-(5-fluoro-3-pyridinyl)phenyl]-3-naphthalen-1-yl-1H-quinazoline-2,4-dione
CID 175627570
3-(2,3-dimethylphenyl)-1H-quinazoline-2,4-dione
CID 12845269
7-(2-chlorophenyl)-3-(4-methyl-3-pyridinyl)-1H-quinazoline-2,4-dione
CID 170772629
3-isoquinolin-4-yl-7-naphthalen-2-yl-1H-quinazoline-2,4-dione
CID 170773945
7-(5-chloro-2-methoxy-4-pyridinyl)-3-isoquinolin-4-yl-1H-quinazoline-2,4-dione
CID 170773339
7-(2-chlorophenyl)-3-(6-methylisoquinolin-4-yl)-1H-quinazoline-2,4-dione
CID 170773275
7-(2-chloro-3-fluoro-5-methoxyphenyl)-3-isoquinolin-4-yl-1H-quinazoline-2,4-dione
CID 170772694

Frequently Asked Questions

What is the IUPAC name of 7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione?
The IUPAC name of 7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione (CID 175627260) is 7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione.
What is the SMILES notation for 7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione?
The canonical SMILES for 7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione is Cc1ccccc1-c1ccc2c(=O)n(-c3cccc4ccccc34)c(=O)[nH]c2c1.
What is the InChIKey of 7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione?
The InChIKey is AUCWZFBMSAPAEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18N2O2/c1-16-7-2-4-10-19(16)18-13-14-21-22(15-18)26-25(29)27(24(21)28)23-12-6-9-17-8-3-5-11-20(17)23/h2-15H,1H3,(H,26,29).
What are the key properties of 7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione?
7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione has a molecular weight of 378.43 g/mol, XLogP of 4.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methylphenyl)-3-naphthalen-1-yl-1H-quinazoline-2,4-dione is sourced from PubChem (CID 175627260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).