2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine

C32H28N2O4 — CID 132941107

IUPAC2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine
SMILESCOc1cccc(-c2nc(-c3cccc(OC)c3)c(-c3cccc(OC)c3)nc2-c2cccc(OC)c2)c1
InChIInChI=1S/C32H28N2O4/c1-35-25-13-5-9-21(17-25)29-30(22-10-6-14-26(18-22)36-2)34-32(24-12-8-16-28(20-24)38-4)31(33-29)23-11-7-15-27(19-23)37-3/h5-20H,1-4H3
InChIKeyWLSMOTCOMOJUSN-UHFFFAOYSA-N
MW504.59 g/mol
LogP7.18
Rot. Bonds8

About 2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine

2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine (PubChem CID 132941107) has the molecular formula C32H28N2O4 and a molecular weight of 504.59 g/mol. Its IUPAC name is 2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine.

Molecular Properties

Compound Name2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine
PubChem CID132941107
Molecular FormulaC32H28N2O4
Molecular Weight504.59 g/mol
Exact Mass504.20
IUPAC Name2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine
SMILESCOc1cccc(-c2nc(-c3cccc(OC)c3)c(-c3cccc(OC)c3)nc2-c2cccc(OC)c2)c1
InChIInChI=1S/C32H28N2O4/c1-35-25-13-5-9-21(17-25)29-30(22-10-6-14-26(18-22)36-2)34-32(24-12-8-16-28(20-24)38-4)31(33-29)23-11-7-15-27(19-23)37-3/h5-20H,1-4H3
InChIKeyWLSMOTCOMOJUSN-UHFFFAOYSA-N
XLogP7.18
TPSA62.70 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500504.59
LogP ≤ 57.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 174719266
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CID 25138852
1-methoxy-4-[3-(3-methoxyphenyl)phenyl]benzene
CID 66934064
2,6-bis(3-methoxyphenyl)-4-phenylpyridine-3,5-dicarbonitrile
CID 176522061
4-(3-methoxyphenyl)pyridine-2,6-diamine
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3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine
CID 101485058
1,3-dimethoxybenzene;1,4-dimethoxybenzene
CID 91359455
3-bromo-2-(3-methoxyphenyl)quinoline
CID 71658570
4-(3-methoxyphenyl)-2,5-dimethyl-1H-pyrimidin-6-one
CID 136955442
3,4-bis(3-methoxyphenyl)isoquinoline
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4,5-dichloro-3-(3-methoxyphenyl)-1H-pyrazole
CID 141358223

Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine?
The IUPAC name of 2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine (CID 132941107) is 2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine.
What is the SMILES notation for 2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine?
The canonical SMILES for 2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine is COc1cccc(-c2nc(-c3cccc(OC)c3)c(-c3cccc(OC)c3)nc2-c2cccc(OC)c2)c1.
What is the InChIKey of 2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine?
The InChIKey is WLSMOTCOMOJUSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H28N2O4/c1-35-25-13-5-9-21(17-25)29-30(22-10-6-14-26(18-22)36-2)34-32(24-12-8-16-28(20-24)38-4)31(33-29)23-11-7-15-27(19-23)37-3/h5-20H,1-4H3.
What are the key properties of 2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine?
2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine has a molecular weight of 504.59 g/mol, XLogP of 7.18, 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(3-methoxyphenyl)pyrazine is sourced from PubChem (CID 132941107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).