2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine

C19H15ClN6 — CID 141103966

IUPAC2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine
SMILESCc1ccc(-c2nc(Cn3cnnn3)cnc2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H15ClN6/c1-13-2-4-15(5-3-13)19-18(14-6-8-16(20)9-7-14)21-10-17(23-19)11-26-12-22-24-25-26/h2-10,12H,11H2,1H3
InChIKeyZAKPMCHAWKZCQH-UHFFFAOYSA-N
MW362.82 g/mol
LogP3.81
Rot. Bonds4

About 2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine

2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine (PubChem CID 141103966) has the molecular formula C19H15ClN6 and a molecular weight of 362.82 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine
PubChem CID141103966
Molecular FormulaC19H15ClN6
Molecular Weight362.82 g/mol
Exact Mass362.10
IUPAC Name2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine
SMILESCc1ccc(-c2nc(Cn3cnnn3)cnc2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H15ClN6/c1-13-2-4-15(5-3-13)19-18(14-6-8-16(20)9-7-14)21-10-17(23-19)11-26-12-22-24-25-26/h2-10,12H,11H2,1H3
InChIKeyZAKPMCHAWKZCQH-UHFFFAOYSA-N
XLogP3.81
TPSA69.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.82
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2,3-bis(4-chlorophenyl)-5-methylpyrazine
CID 14096510
1-[4-[4-(4-chlorophenyl)-5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-2-(tetrazol-1-yl)ethanone
CID 23908185
N'-[5,6-bis(4-chlorophenyl)pyrazin-2-yl]-N'-ethyl-N,N-dimethylethane-1,2-diamine
CID 143313587
1-[5,6-bis(4-chlorophenyl)pyrazin-2-yl]-N,N-diethylpyrrolidin-3-amine
CID 143313402
2-(4-chlorophenyl)-5-(methoxymethyl)-3-[4-(3,3,3-trifluoropropoxy)phenyl]pyrazine
CID 141168344
3-(4-chlorophenyl)-2-(4-methylphenyl)benzo[g]quinoxaline-5,10-dione
CID 138484311
1-benzyl-4-[5,6-bis(4-chlorophenyl)pyrazin-2-yl]-1,4-diazepane
CID 143313316
N-[5,6-bis(4-chlorophenyl)pyrazin-2-yl]-N',N'-diethylbutane-1,4-diamine
CID 143313630
1-[5,6-bis(4-chlorophenyl)pyrazin-2-yl]-N,N-dipropylpiperidin-4-amine
CID 143313735
5-(4-chlorophenyl)-6-(4-methylphenyl)pyrazine-2,3-dicarboxylic acid
CID 69141126
2-[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide
CID 143657498
4-(tetrazol-1-ylmethyl)aniline
CID 10374929

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine?
The IUPAC name of 2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine (CID 141103966) is 2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine.
What is the SMILES notation for 2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine?
The canonical SMILES for 2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine is Cc1ccc(-c2nc(Cn3cnnn3)cnc2-c2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine?
The InChIKey is ZAKPMCHAWKZCQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN6/c1-13-2-4-15(5-3-13)19-18(14-6-8-16(20)9-7-14)21-10-17(23-19)11-26-12-22-24-25-26/h2-10,12H,11H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine?
2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine has a molecular weight of 362.82 g/mol, XLogP of 3.81, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-3-(4-methylphenyl)-5-(tetrazol-1-ylmethyl)pyrazine is sourced from PubChem (CID 141103966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).