3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine — IUPAC name, SMILES, InChIKey & properties

Name: 3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

About 3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine

3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 157279049) has the molecular formula C93H74Br4ClIN24O2S and a molecular weight of 2073.82 g/mol. Its IUPAC name is 3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name	3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID	157279049
Molecular Formula	C93H74Br4ClIN24O2S
Molecular Weight	2073.82 g/mol
Exact Mass	2068.16
IUPAC Name	3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
SMILES	Brc1cnc2c(NCCc3cccnc3)nc(-c3ccccc3)cn12.Brc1cnc2c(NCCc3ccncc3)nc(-c3ccccc3)cn12.CS(=O)(=O)c1ccc(Nc2nc(-c3ccccc3)cn3c(Br)cnc23)cc1.Clc1ccccc1-c1cn2c(Br)cnc2c(NCc2ccncc2)n1.Ic1cnc2c(NCc3ccncc3)nc(-c3ccccc3)cn12
InChI	InChI=1S/2C19H16BrN5.C19H15BrN4O2S.C18H13BrClN5.C18H14IN5/c20-17-12-23-19-18(22-10-8-14-5-4-9-21-11-14)24-16(13-25(17)19)15-6-2-1-3-7-15;20-17-12-23-19-18(22-11-8-14-6-9-21-10-7-14)24-16(13-25(17)19)15-4-2-1-3-5-15;1-27(25,26)15-9-7-14(8-10-15)22-18-19-21-11-17(20)24(19)12-16(23-18)13-5-3-2-4-6-13;19-16-10-23-18-17(22-9-12-5-7-21-8-6-12)24-15(11-25(16)18)13-3-1-2-4-14(13)20;19-16-11-22-18-17(21-10-13-6-8-20-9-7-13)23-15(12-24(16)18)14-4-2-1-3-5-14/h1-7,9,11-13H,8,10H2,(H,22,24);1-7,9-10,12-13H,8,11H2,(H,22,24);2-12H,1H3,(H,22,23);1-8,10-11H,9H2,(H,22,24);1-9,11-12H,10H2,(H,21,23)
InChIKey	AZLGTPBTGSIAFF-UHFFFAOYSA-N
XLogP	21.55
TPSA	296.80 Å²
H-Bond Donors	5
H-Bond Acceptors	26
Rotatable Bonds	22
Heavy Atoms	126
Complexity	—

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2073.82
LogP ≤ 5	21.55
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

Structural Alerts	{'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-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

Frequently Asked Questions

What is the IUPAC name of 3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?

The IUPAC name of 3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine (CID 157279049) is 3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine.

What is the SMILES notation for 3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?

The canonical SMILES for 3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine is Brc1cnc2c(NCCc3cccnc3)nc(-c3ccccc3)cn12.Brc1cnc2c(NCCc3ccncc3)nc(-c3ccccc3)cn12.CS(=O)(=O)c1ccc(Nc2nc(-c3ccccc3)cn3c(Br)cnc23)cc1.Clc1ccccc1-c1cn2c(Br)cnc2c(NCc2ccncc2)n1.Ic1cnc2c(NCc3ccncc3)nc(-c3ccccc3)cn12.

What is the InChIKey of 3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?

The InChIKey is AZLGTPBTGSIAFF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H16BrN5.C19H15BrN4O2S.C18H13BrClN5.C18H14IN5/c20-17-12-23-19-18(22-10-8-14-5-4-9-21-11-14)24-16(13-25(17)19)15-6-2-1-3-7-15;20-17-12-23-19-18(22-11-8-14-6-9-21-10-7-14)24-16(13-25(17)19)15-4-2-1-3-5-15;1-27(25,26)15-9-7-14(8-10-15)22-18-19-21-11-17(20)24(19)12-16(23-18)13-5-3-2-4-6-13;19-16-10-23-18-17(22-9-12-5-7-21-8-6-12)24-15(11-25(16)18)13-3-1-2-4-14(13)20;19-16-11-22-18-17(21-10-13-6-8-20-9-7-13)23-15(12-24(16)18)14-4-2-1-3-5-14/h1-7,9,11-13H,8,10H2,(H,22,24);1-7,9-10,12-13H,8,11H2,(H,22,24);2-12H,1H3,(H,22,23);1-8,10-11H,9H2,(H,22,24);1-9,11-12H,10H2,(H,21,23).

What are the key properties of 3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?

Where does this data come from?

All data for 3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 157279049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).