8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol

C25H17N3O2S — CID 137285392

IUPAC8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol
SMILESOc1c(Cc2ccco2)nc2c(-c3cc4ccccc4s3)nc(-c3ccccc3)cn12
InChIInChI=1S/C25H17N3O2S/c29-25-19(14-18-10-6-12-30-18)27-24-23(22-13-17-9-4-5-11-21(17)31-22)26-20(15-28(24)25)16-7-2-1-3-8-16/h1-13,15,29H,14H2
InChIKeyHJUISNOQAGIWLF-UHFFFAOYSA-N
MW423.50 g/mol
LogP6.17
Rot. Bonds4

About 8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol

8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol (PubChem CID 137285392) has the molecular formula C25H17N3O2S and a molecular weight of 423.50 g/mol. Its IUPAC name is 8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol.

Molecular Properties

Compound Name8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol
PubChem CID137285392
Molecular FormulaC25H17N3O2S
Molecular Weight423.50 g/mol
Exact Mass423.10
IUPAC Name8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol
SMILESOc1c(Cc2ccco2)nc2c(-c3cc4ccccc4s3)nc(-c3ccccc3)cn12
InChIInChI=1S/C25H17N3O2S/c29-25-19(14-18-10-6-12-30-18)27-24-23(22-13-17-9-4-5-11-21(17)31-22)26-20(15-28(24)25)16-7-2-1-3-8-16/h1-13,15,29H,14H2
InChIKeyHJUISNOQAGIWLF-UHFFFAOYSA-N
XLogP6.17
TPSA63.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.50
LogP ≤ 56.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-[5-(Furan-3-yl)thiophen-2-yl]-7-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine
CID 164628907
8-benzyl-2-[(furan-2-yl)methyl]-6-phenyl-3H,7H-imidazo[1,2-a]pyrazin-3-one
CID 136008305
6-(3-amino-2-fluorophenyl)-8-((2-fluorophenyl)methyl)-2-((furan-2-yl)methyl)-3H,7H-imidazo(1,2-a)pyrazin-3-one
CID 146403983
Methyl 2-[[2-ethyl-3-[methyl(thiophene-2-carbonyl)amino]imidazo[1,2-a]pyridin-8-yl]oxymethyl]benzoate
CID 49786527
Methyl 2-[[2-methyl-3-[methyl(thiophen-2-ylmethyl)amino]imidazo[1,2-a]pyridin-8-yl]oxymethyl]benzoate
CID 49790530
N-[2-ethyl-8-[2-(4-fluorophenyl)-2-oxoethoxy]imidazo[1,2-a]pyridin-3-yl]-N-methylthiophene-2-carboxamide
CID 49791166
1-(4-Fluorophenyl)-2-[2-methyl-3-[methyl(thiophen-2-ylmethyl)amino]imidazo[1,2-a]pyridin-8-yl]oxyethanone
CID 46948287
Hydrofurimazine
CID 137285375
8-benzyl-6-(2-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3(7H)-one
CID 137314688
8-Benzyl-6-(2-fluoro-3-nitrophenyl)-2-(furan-2-ylmethyl)imidazo(1,2-a)pyrazin-3(7h)-one
CID 146404016
NanoLuc substrate 1
CID 146404021
NanoLuc substrate 2
CID 146404025

Frequently Asked Questions

What is the IUPAC name of 8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol?
The IUPAC name of 8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol (CID 137285392) is 8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol.
What is the SMILES notation for 8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol?
The canonical SMILES for 8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol is Oc1c(Cc2ccco2)nc2c(-c3cc4ccccc4s3)nc(-c3ccccc3)cn12.
What is the InChIKey of 8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol?
The InChIKey is HJUISNOQAGIWLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17N3O2S/c29-25-19(14-18-10-6-12-30-18)27-24-23(22-13-17-9-4-5-11-21(17)31-22)26-20(15-28(24)25)16-7-2-1-3-8-16/h1-13,15,29H,14H2.
What are the key properties of 8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol?
8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol has a molecular weight of 423.50 g/mol, XLogP of 6.17, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-benzothiophen-2-yl)-2-(furan-2-ylmethyl)-6-phenylimidazo[1,2-a]pyrazin-3-ol is sourced from PubChem (CID 137285392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).