3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine

C20H12ClN5 — CID 72545491

IUPAC3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine
SMILESClc1cccc(-c2cnc3cc(-c4ccc5[nH]ncc5c4)cnc3n2)c1
InChIInChI=1S/C20H12ClN5/c21-16-3-1-2-13(7-16)19-11-22-18-8-14(9-23-20(18)25-19)12-4-5-17-15(6-12)10-24-26-17/h1-11H,(H,24,26)
InChIKeyABFCMUXUOLNWCR-UHFFFAOYSA-N
MW357.80 g/mol
LogP4.89
Rot. Bonds2

About 3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine

3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine (PubChem CID 72545491) has the molecular formula C20H12ClN5 and a molecular weight of 357.80 g/mol. Its IUPAC name is 3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine
PubChem CID72545491
Molecular FormulaC20H12ClN5
Molecular Weight357.80 g/mol
Exact Mass357.08
IUPAC Name3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine
SMILESClc1cccc(-c2cnc3cc(-c4ccc5[nH]ncc5c4)cnc3n2)c1
InChIInChI=1S/C20H12ClN5/c21-16-3-1-2-13(7-16)19-11-22-18-8-14(9-23-20(18)25-19)12-4-5-17-15(6-12)10-24-26-17/h1-11H,(H,24,26)
InChIKeyABFCMUXUOLNWCR-UHFFFAOYSA-N
XLogP4.89
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.80
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine?
The IUPAC name of 3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine (CID 72545491) is 3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine.
What is the SMILES notation for 3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine?
The canonical SMILES for 3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine is Clc1cccc(-c2cnc3cc(-c4ccc5[nH]ncc5c4)cnc3n2)c1.
What is the InChIKey of 3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine?
The InChIKey is ABFCMUXUOLNWCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12ClN5/c21-16-3-1-2-13(7-16)19-11-22-18-8-14(9-23-20(18)25-19)12-4-5-17-15(6-12)10-24-26-17/h1-11H,(H,24,26).
What are the key properties of 3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine?
3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine has a molecular weight of 357.80 g/mol, XLogP of 4.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chlorophenyl)-7-(1H-indazol-5-yl)pyrido[2,3-b]pyrazine is sourced from PubChem (CID 72545491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).