6-bromo-N,2-diphenylquinazolin-4-amine

C20H14BrN3 — CID 23910410

IUPAC6-bromo-N,2-diphenylquinazolin-4-amine
SMILESBrc1ccc2nc(-c3ccccc3)nc(Nc3ccccc3)c2c1
InChIInChI=1S/C20H14BrN3/c21-15-11-12-18-17(13-15)20(22-16-9-5-2-6-10-16)24-19(23-18)14-7-3-1-4-8-14/h1-13H,(H,22,23,24)
InChIKeyBISNEWMRVYMRHH-UHFFFAOYSA-N
MW376.26 g/mol
LogP5.80
Rot. Bonds3

About 6-bromo-N,2-diphenylquinazolin-4-amine

6-bromo-N,2-diphenylquinazolin-4-amine (PubChem CID 23910410) has the molecular formula C20H14BrN3 and a molecular weight of 376.26 g/mol. Its IUPAC name is 6-bromo-N,2-diphenylquinazolin-4-amine.

Molecular Properties

Compound Name6-bromo-N,2-diphenylquinazolin-4-amine
PubChem CID23910410
Molecular FormulaC20H14BrN3
Molecular Weight376.26 g/mol
Exact Mass375.04
IUPAC Name6-bromo-N,2-diphenylquinazolin-4-amine
SMILESBrc1ccc2nc(-c3ccccc3)nc(Nc3ccccc3)c2c1
InChIInChI=1S/C20H14BrN3/c21-15-11-12-18-17(13-15)20(22-16-9-5-2-6-10-16)24-19(23-18)14-7-3-1-4-8-14/h1-13H,(H,22,23,24)
InChIKeyBISNEWMRVYMRHH-UHFFFAOYSA-N
XLogP5.80
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.26
LogP ≤ 55.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-bromo-N-(3,4-dimethylphenyl)-2-phenylquinazolin-4-amine
CID 23909624
6-bromo-2-phenylquinazolin-4-amine
CID 15879877
6-bromo-N-(2,4-dimethoxyphenyl)-2-phenylquinazolin-4-amine
CID 23738095
1-[(6-bromo-2-phenylquinazolin-4-yl)amino]propan-2-ol
CID 23906351
3-[(2-phenylquinazolin-4-yl)amino]benzoic acid;hydrochloride
CID 2894714
2-phenyl-N-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine
CID 11162349
6,7-dimethoxy-2-(4-methoxyphenyl)-N-phenylquinazolin-4-amine
CID 117088726
6-bromo-N-methyl-2-(3-methylphenyl)quinazolin-4-amine
CID 64981581
2-phenyl-N-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine
CID 11771006
N-(4-phenoxyphenyl)-2-phenylquinazolin-4-amine
CID 11567274
6-bromo-2-(5-bromothiophen-3-yl)-N-methylquinazolin-4-amine
CID 107966582
3-[[6-fluoro-2-(3-fluorophenyl)quinazolin-4-yl]amino]phenol
CID 53329929

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N,2-diphenylquinazolin-4-amine?
The IUPAC name of 6-bromo-N,2-diphenylquinazolin-4-amine (CID 23910410) is 6-bromo-N,2-diphenylquinazolin-4-amine.
What is the SMILES notation for 6-bromo-N,2-diphenylquinazolin-4-amine?
The canonical SMILES for 6-bromo-N,2-diphenylquinazolin-4-amine is Brc1ccc2nc(-c3ccccc3)nc(Nc3ccccc3)c2c1.
What is the InChIKey of 6-bromo-N,2-diphenylquinazolin-4-amine?
The InChIKey is BISNEWMRVYMRHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14BrN3/c21-15-11-12-18-17(13-15)20(22-16-9-5-2-6-10-16)24-19(23-18)14-7-3-1-4-8-14/h1-13H,(H,22,23,24).
What are the key properties of 6-bromo-N,2-diphenylquinazolin-4-amine?
6-bromo-N,2-diphenylquinazolin-4-amine has a molecular weight of 376.26 g/mol, XLogP of 5.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N,2-diphenylquinazolin-4-amine is sourced from PubChem (CID 23910410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).