N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine

C12H9BrCl2N6 — CID 107795439

IUPACN-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
SMILESNNc1cn2ccnc2c(Nc2ccc(Br)c(Cl)c2Cl)n1
InChIInChI=1S/C12H9BrCl2N6/c13-6-1-2-7(10(15)9(6)14)18-11-12-17-3-4-21(12)5-8(19-11)20-16/h1-5,20H,16H2,(H,18,19)
InChIKeyXUEIPFJZIOYLBE-UHFFFAOYSA-N
MW388.06 g/mol
LogP3.83
Rot. Bonds3

About N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine

N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine (PubChem CID 107795439) has the molecular formula C12H9BrCl2N6 and a molecular weight of 388.06 g/mol. Its IUPAC name is N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
PubChem CID107795439
Molecular FormulaC12H9BrCl2N6
Molecular Weight388.06 g/mol
Exact Mass385.94
IUPAC NameN-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
SMILESNNc1cn2ccnc2c(Nc2ccc(Br)c(Cl)c2Cl)n1
InChIInChI=1S/C12H9BrCl2N6/c13-6-1-2-7(10(15)9(6)14)18-11-12-17-3-4-21(12)5-8(19-11)20-16/h1-5,20H,16H2,(H,18,19)
InChIKeyXUEIPFJZIOYLBE-UHFFFAOYSA-N
XLogP3.83
TPSA80.27 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.06
LogP ≤ 53.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

8-N-(4-bromo-2,3-dichlorophenyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 107794870
N-(2,5-dibromophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
CID 80896841
6-hydrazinyl-N-phenylimidazo[1,2-a]pyrazin-8-amine
CID 80920384
N-(2-chloro-5-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
CID 80900641
N-(5-chloro-2-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
CID 80912403
8-N-(2-bromophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80761144
5-fluoro-2-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]benzonitrile
CID 82682483
6-hydrazinyl-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 80928287
8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
CID 107639344
N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
CID 107623718
6-hydrazinyl-N-propan-2-ylimidazo[1,2-a]pyrazin-8-amine
CID 80932271
8-N-(2-bromo-3-chlorophenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
CID 103481971

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine (CID 107795439) is N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine is NNc1cn2ccnc2c(Nc2ccc(Br)c(Cl)c2Cl)n1.
What is the InChIKey of N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine?
The InChIKey is XUEIPFJZIOYLBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrCl2N6/c13-6-1-2-7(10(15)9(6)14)18-11-12-17-3-4-21(12)5-8(19-11)20-16/h1-5,20H,16H2,(H,18,19).
What are the key properties of N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine?
N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine has a molecular weight of 388.06 g/mol, XLogP of 3.83, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 107795439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).