6-bromo-2-(2-chlorophenyl)quinazolin-4-amine

C14H9BrClN3 — CID 64983536

IUPAC6-bromo-2-(2-chlorophenyl)quinazolin-4-amine
SMILESNc1nc(-c2ccccc2Cl)nc2ccc(Br)cc12
InChIInChI=1S/C14H9BrClN3/c15-8-5-6-12-10(7-8)13(17)19-14(18-12)9-3-1-2-4-11(9)16/h1-7H,(H2,17,18,19)
InChIKeyMABIYHCNBHDKBH-UHFFFAOYSA-N
MW334.60 g/mol
LogP4.29
Rot. Bonds1

About 6-bromo-2-(2-chlorophenyl)quinazolin-4-amine

6-bromo-2-(2-chlorophenyl)quinazolin-4-amine (PubChem CID 64983536) has the molecular formula C14H9BrClN3 and a molecular weight of 334.60 g/mol. Its IUPAC name is 6-bromo-2-(2-chlorophenyl)quinazolin-4-amine.

Molecular Properties

Compound Name6-bromo-2-(2-chlorophenyl)quinazolin-4-amine
PubChem CID64983536
Molecular FormulaC14H9BrClN3
Molecular Weight334.60 g/mol
Exact Mass332.97
IUPAC Name6-bromo-2-(2-chlorophenyl)quinazolin-4-amine
SMILESNc1nc(-c2ccccc2Cl)nc2ccc(Br)cc12
InChIInChI=1S/C14H9BrClN3/c15-8-5-6-12-10(7-8)13(17)19-14(18-12)9-3-1-2-4-11(9)16/h1-7H,(H2,17,18,19)
InChIKeyMABIYHCNBHDKBH-UHFFFAOYSA-N
XLogP4.29
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.60
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Smer 28
CID 1560402
2,4-Quinazolinediamine, 5-chloro-
CID 205130
N~2~-(3-chloro-4-methylphenyl)-2,4-quinazolinediamine hydrochloride
CID 2972826
1,4-Pentanediamine, N(sup 4)-(2-(2-(4-bromophenyl)ethenyl)-7-chloro-4-quinazolinyl)-N(sup 1),N(sup 1)-diethyl-
CID 5285750
6-bromo-N2-phenylquinazoline-2,4-diamine
CID 145998261
6-bromo-N-m-tolylquinazolin-4-amine
CID 720633
6-bromo-N-(3-chlorophenyl)quinazolin-4-amine
CID 720635
2-N-(3-chloro-4-methylphenyl)quinazoline-2,4-diamine
CID 2227970
N-(3-bromophenyl)-6-chloroquinazolin-4-amine
CID 11056756
6-Bromo-2-methoxy-4-phenylquinazoline
CID 746070
(4-Chloro-phenyl)-(2-phenyl-quinazolin-4-yl)-amine
CID 10359377
4-Chloro-2-phenylquinazoline
CID 80977

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(2-chlorophenyl)quinazolin-4-amine?
The IUPAC name of 6-bromo-2-(2-chlorophenyl)quinazolin-4-amine (CID 64983536) is 6-bromo-2-(2-chlorophenyl)quinazolin-4-amine.
What is the SMILES notation for 6-bromo-2-(2-chlorophenyl)quinazolin-4-amine?
The canonical SMILES for 6-bromo-2-(2-chlorophenyl)quinazolin-4-amine is Nc1nc(-c2ccccc2Cl)nc2ccc(Br)cc12.
What is the InChIKey of 6-bromo-2-(2-chlorophenyl)quinazolin-4-amine?
The InChIKey is MABIYHCNBHDKBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9BrClN3/c15-8-5-6-12-10(7-8)13(17)19-14(18-12)9-3-1-2-4-11(9)16/h1-7H,(H2,17,18,19).
What are the key properties of 6-bromo-2-(2-chlorophenyl)quinazolin-4-amine?
6-bromo-2-(2-chlorophenyl)quinazolin-4-amine has a molecular weight of 334.60 g/mol, XLogP of 4.29, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(2-chlorophenyl)quinazolin-4-amine is sourced from PubChem (CID 64983536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).