2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline

C27H20N2 — CID 159677952

IUPAC2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline
SMILESCc1nc(-c2ccccc2)c2ccc(-c3cccc(-c4ccccc4)c3)cc2n1
InChIInChI=1S/C27H20N2/c1-19-28-26-18-24(15-16-25(26)27(29-19)21-11-6-3-7-12-21)23-14-8-13-22(17-23)20-9-4-2-5-10-20/h2-18H,1H3
InChIKeyNXOCTNBINSVBOX-UHFFFAOYSA-N
MW372.47 g/mol
LogP6.94
Rot. Bonds3

About 2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline

2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline (PubChem CID 159677952) has the molecular formula C27H20N2 and a molecular weight of 372.47 g/mol. Its IUPAC name is 2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline.

Molecular Properties

Compound Name2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline
PubChem CID159677952
Molecular FormulaC27H20N2
Molecular Weight372.47 g/mol
Exact Mass372.16
IUPAC Name2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline
SMILESCc1nc(-c2ccccc2)c2ccc(-c3cccc(-c4ccccc4)c3)cc2n1
InChIInChI=1S/C27H20N2/c1-19-28-26-18-24(15-16-25(26)27(29-19)21-11-6-3-7-12-21)23-14-8-13-22(17-23)20-9-4-2-5-10-20/h2-18H,1H3
InChIKeyNXOCTNBINSVBOX-UHFFFAOYSA-N
XLogP6.94
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.47
LogP ≤ 56.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-4-phenyl-6-(4-phenylphenyl)quinazoline
CID 161216404
5-deuterio-2-methyl-4,7-diphenylquinazoline
CID 159932921
4,7-diphenyl-2-[3-(4-phenylphenyl)-5-pyrimidin-2-ylphenyl]quinazoline
CID 144968804
2-[3,5-bis(4,6-diphenyl-2-pyridinyl)phenyl]-4,7-diphenylquinazoline
CID 118552110
6-bromo-2-methyl-4-phenylquinazoline
CID 4713931
4-phenyl-2-[3-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]quinazoline
CID 155156227
2-[4-(4-phenylphenyl)phenyl]-4-[3-[3-[4-[4-(4-phenylphenyl)phenyl]quinazolin-2-yl]phenyl]phenyl]quinazoline
CID 146825143
2-methyl-4-(3-phenylphenyl)pyrido[2,3-d]pyrimidine
CID 144858513
4,7-diphenyl-2-[3-phenyl-5-[4-(4-pyridin-3-ylphenyl)phenyl]phenyl]quinazoline
CID 118552649
2,4-dimethyl-6-[3-(3-phenylphenyl)-5-triphenylen-2-ylphenyl]-1,3,5-triazine
CID 130355599
2-methyl-6-nitro-4-phenylquinazoline
CID 4662097
7-(3-dibenzothiophen-3-ylphenyl)-2,4-diphenylquinazoline
CID 165028329

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline?
The IUPAC name of 2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline (CID 159677952) is 2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline.
What is the SMILES notation for 2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline?
The canonical SMILES for 2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline is Cc1nc(-c2ccccc2)c2ccc(-c3cccc(-c4ccccc4)c3)cc2n1.
What is the InChIKey of 2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline?
The InChIKey is NXOCTNBINSVBOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20N2/c1-19-28-26-18-24(15-16-25(26)27(29-19)21-11-6-3-7-12-21)23-14-8-13-22(17-23)20-9-4-2-5-10-20/h2-18H,1H3.
What are the key properties of 2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline?
2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline has a molecular weight of 372.47 g/mol, XLogP of 6.94, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-phenyl-7-(3-phenylphenyl)quinazoline is sourced from PubChem (CID 159677952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).