2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine

C32H20Cl4N6 — CID 54264747

IUPAC2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine
SMILESClc1ccc(C=Cc2nc(C=Cc3ccc(Cl)cn3)c(C=Cc3ccc(Cl)cn3)nc2C=Cc2ccc(Cl)cn2)nc1
InChIInChI=1S/C32H20Cl4N6/c33-21-1-5-25(37-17-21)9-13-29-30(14-10-26-6-2-22(34)18-38-26)42-32(16-12-28-8-4-24(36)20-40-28)31(41-29)15-11-27-7-3-23(35)19-39-27/h1-20H
InChIKeyRFYVFDDEDOODOR-UHFFFAOYSA-N
MW630.37 g/mol
LogP9.35
Rot. Bonds8

About 2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine

2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine (PubChem CID 54264747) has the molecular formula C32H20Cl4N6 and a molecular weight of 630.37 g/mol. Its IUPAC name is 2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine.

Molecular Properties

Compound Name2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine
PubChem CID54264747
Molecular FormulaC32H20Cl4N6
Molecular Weight630.37 g/mol
Exact Mass628.05
IUPAC Name2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine
SMILESClc1ccc(C=Cc2nc(C=Cc3ccc(Cl)cn3)c(C=Cc3ccc(Cl)cn3)nc2C=Cc2ccc(Cl)cn2)nc1
InChIInChI=1S/C32H20Cl4N6/c33-21-1-5-25(37-17-21)9-13-29-30(14-10-26-6-2-22(34)18-38-26)42-32(16-12-28-8-4-24(36)20-40-28)31(41-29)15-11-27-7-3-23(35)19-39-27/h1-20H
InChIKeyRFYVFDDEDOODOR-UHFFFAOYSA-N
XLogP9.35
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500630.37
LogP ≤ 59.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-[2-[3,5,6-tris[2-(5-carboxy-2-pyridinyl)ethenyl]pyrazin-2-yl]ethenyl]pyridine-3-carboxylic acid
CID 54492377
4-(5-chloro-2-pyridinyl)but-3-enoic acid
CID 170483056
tributyl-[(E)-2-(5-chloro-2-pyridinyl)ethenyl]stannane
CID 90198690
N-[3-(5-chloro-2-pyridinyl)prop-2-enyl]acetamide
CID 169464897
5-chloro-2-[(E)-2-(4-fluorophenyl)sulfonylethenyl]pyridine
CID 162658794
CID 89343940
CID 89343940
(R)-N-[(5-chloro-2-pyridinyl)methylidene]-2-methylpropane-2-sulfinamide
CID 138110985
2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine
CID 139611350
7-chloro-2-ethenyl-1,5-naphthyridine
CID 175287395
carbonic acid;2,5-dichloropyridine
CID 159285207
5-chloro-N-[(Z)-prop-1-enyl]pyridin-2-amine
CID 89116538
2-chloro-3-[(E)-2-pyridin-2-ylethenyl]quinoxaline
CID 134098470

Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine?
The IUPAC name of 2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine (CID 54264747) is 2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine.
What is the SMILES notation for 2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine?
The canonical SMILES for 2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine is Clc1ccc(C=Cc2nc(C=Cc3ccc(Cl)cn3)c(C=Cc3ccc(Cl)cn3)nc2C=Cc2ccc(Cl)cn2)nc1.
What is the InChIKey of 2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine?
The InChIKey is RFYVFDDEDOODOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H20Cl4N6/c33-21-1-5-25(37-17-21)9-13-29-30(14-10-26-6-2-22(34)18-38-26)42-32(16-12-28-8-4-24(36)20-40-28)31(41-29)15-11-27-7-3-23(35)19-39-27/h1-20H.
What are the key properties of 2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine?
2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine has a molecular weight of 630.37 g/mol, XLogP of 9.35, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetrakis[2-(5-chloro-2-pyridinyl)ethenyl]pyrazine is sourced from PubChem (CID 54264747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).