5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine

C10H6Br2ClN3 — CID 115568327

IUPAC5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine
SMILESNc1nc(-c2ccc(Cl)c(Br)c2)ncc1Br
InChIInChI=1S/C10H6Br2ClN3/c11-6-3-5(1-2-8(6)13)10-15-4-7(12)9(14)16-10/h1-4H,(H2,14,15,16)
InChIKeyJCDUTXWQIMHPBM-UHFFFAOYSA-N
MW363.44 g/mol
LogP3.90
Rot. Bonds1

About 5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine

5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine (PubChem CID 115568327) has the molecular formula C10H6Br2ClN3 and a molecular weight of 363.44 g/mol. Its IUPAC name is 5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine
PubChem CID115568327
Molecular FormulaC10H6Br2ClN3
Molecular Weight363.44 g/mol
Exact Mass360.86
IUPAC Name5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine
SMILESNc1nc(-c2ccc(Cl)c(Br)c2)ncc1Br
InChIInChI=1S/C10H6Br2ClN3/c11-6-3-5(1-2-8(6)13)10-15-4-7(12)9(14)16-10/h1-4H,(H2,14,15,16)
InChIKeyJCDUTXWQIMHPBM-UHFFFAOYSA-N
XLogP3.90
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.44
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-bromo-4-chlorophenyl)-4,6-dichloropyrimidine
CID 115565759
5-bromo-2-(3-bromo-4-fluorophenyl)-4-chloropyrimidine
CID 82809152
5-bromo-2-(4-fluoro-3-methoxyphenyl)pyrimidin-4-amine
CID 107922895
5-bromo-2-pyridin-3-ylpyrimidin-4-amine
CID 66302850
2-(4-bromo-3-fluorophenyl)-5-iodopyrimidin-4-amine
CID 81440933
1-[2-(3-bromo-4-chlorophenyl)pyrimidin-5-yl]-N-methylmethanamine
CID 113337352
2-(3-bromo-4-chlorophenyl)-4-propan-2-ylpyrimidine-5-carboxylic acid
CID 115568146
5-bromo-2-(3-propan-2-yloxyphenyl)pyrimidin-4-amine
CID 66296825
4-(3-bromo-4-chlorophenyl)-6-ethyl-1,3,5-triazin-2-amine
CID 115568668
5-bromo-2-(4-propoxyphenyl)pyrimidin-4-amine
CID 66296050
1-[2-(3-bromo-4-chlorophenyl)pyrimidin-4-yl]propan-2-amine
CID 113337356
3-[5-(3-bromo-4-chlorophenyl)-1,2,4-oxadiazol-3-yl]aniline
CID 103844013

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine?
The IUPAC name of 5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine (CID 115568327) is 5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine.
What is the SMILES notation for 5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine?
The canonical SMILES for 5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine is Nc1nc(-c2ccc(Cl)c(Br)c2)ncc1Br.
What is the InChIKey of 5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine?
The InChIKey is JCDUTXWQIMHPBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2ClN3/c11-6-3-5(1-2-8(6)13)10-15-4-7(12)9(14)16-10/h1-4H,(H2,14,15,16).
What are the key properties of 5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine?
5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine has a molecular weight of 363.44 g/mol, XLogP of 3.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine is sourced from PubChem (CID 115568327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).