2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine

C23H20N4O3 — CID 165177913

IUPAC2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine
SMILESCOc1cc(-c2nccn3cc(-c4ccc5[nH]ccc5c4)nc23)cc(OC)c1OC
InChIInChI=1S/C23H20N4O3/c1-28-19-11-16(12-20(29-2)22(19)30-3)21-23-26-18(13-27(23)9-8-25-21)14-4-5-17-15(10-14)6-7-24-17/h4-13,24H,1-3H3
InChIKeyXGURHMRINASWSW-UHFFFAOYSA-N
MW400.44 g/mol
LogP4.57
Rot. Bonds5

About 2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine

2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine (PubChem CID 165177913) has the molecular formula C23H20N4O3 and a molecular weight of 400.44 g/mol. Its IUPAC name is 2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine
PubChem CID165177913
Molecular FormulaC23H20N4O3
Molecular Weight400.44 g/mol
Exact Mass400.15
IUPAC Name2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine
SMILESCOc1cc(-c2nccn3cc(-c4ccc5[nH]ccc5c4)nc23)cc(OC)c1OC
InChIInChI=1S/C23H20N4O3/c1-28-19-11-16(12-20(29-2)22(19)30-3)21-23-26-18(13-27(23)9-8-25-21)14-4-5-17-15(10-14)6-7-24-17/h4-13,24H,1-3H3
InChIKeyXGURHMRINASWSW-UHFFFAOYSA-N
XLogP4.57
TPSA73.67 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.44
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine?
The IUPAC name of 2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine (CID 165177913) is 2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine.
What is the SMILES notation for 2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine?
The canonical SMILES for 2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine is COc1cc(-c2nccn3cc(-c4ccc5[nH]ccc5c4)nc23)cc(OC)c1OC.
What is the InChIKey of 2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine?
The InChIKey is XGURHMRINASWSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O3/c1-28-19-11-16(12-20(29-2)22(19)30-3)21-23-26-18(13-27(23)9-8-25-21)14-4-5-17-15(10-14)6-7-24-17/h4-13,24H,1-3H3.
What are the key properties of 2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine?
2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine has a molecular weight of 400.44 g/mol, XLogP of 4.57, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-5-yl)-8-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazine is sourced from PubChem (CID 165177913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).