N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine

C26H19N3O — CID 11567274

IUPACN-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine
SMILESc1ccc(Oc2ccc(Nc3nc(-c4ccccc4)nc4ccccc34)cc2)cc1
InChIInChI=1S/C26H19N3O/c1-3-9-19(10-4-1)25-28-24-14-8-7-13-23(24)26(29-25)27-20-15-17-22(18-16-20)30-21-11-5-2-6-12-21/h1-18H,(H,27,28,29)
InChIKeyYGEYGCAYGPJRJC-UHFFFAOYSA-N
MW389.46 g/mol
LogP6.83
Rot. Bonds5

About N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine

N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine (PubChem CID 11567274) has the molecular formula C26H19N3O and a molecular weight of 389.46 g/mol. Its IUPAC name is N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine.

Molecular Properties

Compound NameN-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine
PubChem CID11567274
Molecular FormulaC26H19N3O
Molecular Weight389.46 g/mol
Exact Mass389.15
IUPAC NameN-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine
SMILESc1ccc(Oc2ccc(Nc3nc(-c4ccccc4)nc4ccccc34)cc2)cc1
InChIInChI=1S/C26H19N3O/c1-3-9-19(10-4-1)25-28-24-14-8-7-13-23(24)26(29-25)27-20-15-17-22(18-16-20)30-21-11-5-2-6-12-21/h1-18H,(H,27,28,29)
InChIKeyYGEYGCAYGPJRJC-UHFFFAOYSA-N
XLogP6.83
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.46
LogP ≤ 56.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methylphenyl)-N-(4-phenoxyphenyl)quinazolin-4-amine
CID 22310718
N-(4-ethoxyphenyl)-2-phenylquinazolin-4-amine
CID 2459759
N-[4-(4-chlorophenoxy)phenyl]-2-(3-methylphenyl)quinazolin-4-amine
CID 4190081
methyl 4-[(2-phenylquinazolin-4-yl)amino]benzoate
CID 1183964
2-(4-fluorophenyl)-N-(4-methylphenyl)quinazolin-4-amine
CID 135058525
2-(4-methoxyphenyl)-N-(4-phenylmethoxyphenyl)quinazolin-4-amine
CID 23824682
N-(3,4-dimethylphenyl)-2-(4-methoxyphenyl)quinazolin-4-amine
CID 20963225
2-phenyl-N-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine
CID 11771006
2-(4-phenoxyanilino)-3,1-benzoxazin-4-one
CID 18762620
N-(3-fluoro-4-methylphenyl)-2-(4-methoxyphenyl)quinazolin-4-amine
CID 20963104
N-[4-(2-methylsulfonylethyl)phenyl]-2-phenylquinazolin-4-amine
CID 133398069
methyl 4-[[2-(4-methylphenyl)quinazolin-4-yl]amino]benzoate
CID 1187533

Frequently Asked Questions

What is the IUPAC name of N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine?
The IUPAC name of N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine (CID 11567274) is N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine.
What is the SMILES notation for N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine?
The canonical SMILES for N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine is c1ccc(Oc2ccc(Nc3nc(-c4ccccc4)nc4ccccc34)cc2)cc1.
What is the InChIKey of N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine?
The InChIKey is YGEYGCAYGPJRJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19N3O/c1-3-9-19(10-4-1)25-28-24-14-8-7-13-23(24)26(29-25)27-20-15-17-22(18-16-20)30-21-11-5-2-6-12-21/h1-18H,(H,27,28,29).
What are the key properties of N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine?
N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine has a molecular weight of 389.46 g/mol, XLogP of 6.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine is sourced from PubChem (CID 11567274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).