7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine

C20H14ClN3 — CID 167985419

IUPAC7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine
SMILESCc1nc2nccnc2cc1-c1cccc(-c2ccc(Cl)cc2)c1
InChIInChI=1S/C20H14ClN3/c1-13-18(12-19-20(24-13)23-10-9-22-19)16-4-2-3-15(11-16)14-5-7-17(21)8-6-14/h2-12H,1H3
InChIKeyHBKJDZHLXIADIU-UHFFFAOYSA-N
MW331.81 g/mol
LogP5.32
Rot. Bonds2

About 7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine

7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine (PubChem CID 167985419) has the molecular formula C20H14ClN3 and a molecular weight of 331.81 g/mol. Its IUPAC name is 7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine
PubChem CID167985419
Molecular FormulaC20H14ClN3
Molecular Weight331.81 g/mol
Exact Mass331.09
IUPAC Name7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine
SMILESCc1nc2nccnc2cc1-c1cccc(-c2ccc(Cl)cc2)c1
InChIInChI=1S/C20H14ClN3/c1-13-18(12-19-20(24-13)23-10-9-22-19)16-4-2-3-15(11-16)14-5-7-17(21)8-6-14/h2-12H,1H3
InChIKeyHBKJDZHLXIADIU-UHFFFAOYSA-N
XLogP5.32
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.81
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-3-methylpyrazine
CID 90168238
2-(4-chlorophenyl)-4-phenyl-6-[4-[3-(4-phenylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 142425266
2-(4-chlorophenyl)-4-phenyl-6-[3-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 142425295
2-[3-(4-chlorophenyl)phenyl]-4,6-bis(2-phenylphenyl)-1,3,5-triazine
CID 154697410
1,4-dichloro-2-(3-phenylphenyl)benzene
CID 86205673
4,6-bis(4-chlorophenyl)quinoline
CID 11187194
1-methyl-4-[2-(3-phenylphenyl)phenyl]benzene
CID 58390014
6-[3-(4-chlorophenyl)phenyl]-1,2,4-triazine-3,5-diamine
CID 121410399
butane;1-chloro-4-(3-methylphenyl)benzene
CID 143529938
3-(4-chlorophenyl)benzenesulfonyl chloride
CID 3502760
4-[3-(4-chlorophenyl)phenyl]-1-methyl-3-propan-2-ylpyrazole
CID 166333754
1-[3-(4-chlorophenyl)phenyl]-2,3,4,5,6,7,8-heptadeuterionaphthalene
CID 168846070

Frequently Asked Questions

What is the IUPAC name of 7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine?
The IUPAC name of 7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine (CID 167985419) is 7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine.
What is the SMILES notation for 7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine?
The canonical SMILES for 7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine is Cc1nc2nccnc2cc1-c1cccc(-c2ccc(Cl)cc2)c1.
What is the InChIKey of 7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine?
The InChIKey is HBKJDZHLXIADIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14ClN3/c1-13-18(12-19-20(24-13)23-10-9-22-19)16-4-2-3-15(11-16)14-5-7-17(21)8-6-14/h2-12H,1H3.
What are the key properties of 7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine?
7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine has a molecular weight of 331.81 g/mol, XLogP of 5.32, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine is sourced from PubChem (CID 167985419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).