N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine

C14H8BrClFN3 — CID 107602343

IUPACN-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine
SMILESFc1cccc(Br)c1Nc1nc(Cl)nc2ccccc12
InChIInChI=1S/C14H8BrClFN3/c15-9-5-3-6-10(17)12(9)19-13-8-4-1-2-7-11(8)18-14(16)20-13/h1-7H,(H,18,19,20)
InChIKeySJBAREPECGCGRI-UHFFFAOYSA-N
MW352.59 g/mol
LogP4.93
Rot. Bonds2

About N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine

N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine (PubChem CID 107602343) has the molecular formula C14H8BrClFN3 and a molecular weight of 352.59 g/mol. Its IUPAC name is N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine.

Molecular Properties

Compound NameN-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine
PubChem CID107602343
Molecular FormulaC14H8BrClFN3
Molecular Weight352.59 g/mol
Exact Mass350.96
IUPAC NameN-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine
SMILESFc1cccc(Br)c1Nc1nc(Cl)nc2ccccc12
InChIInChI=1S/C14H8BrClFN3/c15-9-5-3-6-10(17)12(9)19-13-8-4-1-2-7-11(8)18-14(16)20-13/h1-7H,(H,18,19,20)
InChIKeySJBAREPECGCGRI-UHFFFAOYSA-N
XLogP4.93
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.59
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloroquinazolin-4-amine
CID 107593343
2-chloro-N-(3,5-difluorophenyl)quinazolin-4-amine
CID 62477687
2-chloro-N-(4-chlorophenyl)quinazolin-4-amine
CID 22692704
N-(2,6-dibromophenyl)-2-hydrazinylquinazolin-4-amine
CID 107604857
2-chloro-N-(3,5-dichloro-4-fluorophenyl)quinazolin-4-amine
CID 107576871
N-(2-bromo-6-fluorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine
CID 107602362
3-[(2-chloroquinazolin-4-yl)amino]phenol
CID 22692943
N-(5-bromo-2-chlorophenyl)-2-chloroquinazolin-4-amine
CID 63548575
4-[(2-chloroquinazolin-4-yl)amino]phenol
CID 22692945
2-chloro-N-(2,4-dichlorophenyl)quinazolin-4-amine
CID 22692895
2-(2-bromo-6-fluoroanilino)quinoline-3-carbonitrile
CID 107600392
N-[2-(2-bromophenyl)ethyl]-2-chloroquinazolin-4-amine
CID 142747337

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine?
The IUPAC name of N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine (CID 107602343) is N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine.
What is the SMILES notation for N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine?
The canonical SMILES for N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine is Fc1cccc(Br)c1Nc1nc(Cl)nc2ccccc12.
What is the InChIKey of N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine?
The InChIKey is SJBAREPECGCGRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8BrClFN3/c15-9-5-3-6-10(17)12(9)19-13-8-4-1-2-7-11(8)18-14(16)20-13/h1-7H,(H,18,19,20).
What are the key properties of N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine?
N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine has a molecular weight of 352.59 g/mol, XLogP of 4.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-6-fluorophenyl)-2-chloroquinazolin-4-amine is sourced from PubChem (CID 107602343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).