6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline

C23H14N2S — CID 162406863

IUPAC6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline
SMILESc1ccc2sc(-c3nc4ccccc4n4c3cc3ccccc34)cc2c1
InChIInChI=1S/C23H14N2S/c1-4-10-18-15(7-1)13-20-23(22-14-16-8-2-6-12-21(16)26-22)24-17-9-3-5-11-19(17)25(18)20/h1-14H
InChIKeySXXLPMHKOBVYPY-UHFFFAOYSA-N
MW350.45 g/mol
LogP6.52
Rot. Bonds1

About 6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline

6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline (PubChem CID 162406863) has the molecular formula C23H14N2S and a molecular weight of 350.45 g/mol. Its IUPAC name is 6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline.

Molecular Properties

Compound Name6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline
PubChem CID162406863
Molecular FormulaC23H14N2S
Molecular Weight350.45 g/mol
Exact Mass350.09
IUPAC Name6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline
SMILESc1ccc2sc(-c3nc4ccccc4n4c3cc3ccccc34)cc2c1
InChIInChI=1S/C23H14N2S/c1-4-10-18-15(7-1)13-20-23(22-14-16-8-2-6-12-21(16)26-22)24-17-9-3-5-11-19(17)25(18)20/h1-14H
InChIKeySXXLPMHKOBVYPY-UHFFFAOYSA-N
XLogP6.52
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.45
LogP ≤ 56.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-dibenzothiophen-4-ylphenyl)indolo[1,2-a]quinoxaline
CID 145180261
2-(1-benzothiophen-2-yl)-1-phenylbenzimidazole
CID 134337994
6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline
CID 145180197
6-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[1,2-a]quinoxaline
CID 145180354
15-(4-indolo[1,2-a]quinoxalin-6-ylphenyl)-25-phenyl-5-thia-15,25-diazaheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6,8,10,12,17,19,21,23,26-dodecaene
CID 145180265
6-[4-[3-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline
CID 145180375
6-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]indolo[1,2-a]quinoxaline
CID 145180592
6-[3-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]indolo[1,2-a]quinoxaline
CID 145180162
5-(1-benzothiophen-2-yl)pyrido[3,4-b]pyrazine
CID 170567146
2-(1-benzothiophen-2-yl)-4-methylquinoline
CID 71817881
5-(1-benzothiophen-2-yl)-3H-1,3,4-oxadiazole-2-thione
CID 61406424
6-[3-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline
CID 145180126

Frequently Asked Questions

What is the IUPAC name of 6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline?
The IUPAC name of 6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline (CID 162406863) is 6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline.
What is the SMILES notation for 6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline?
The canonical SMILES for 6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline is c1ccc2sc(-c3nc4ccccc4n4c3cc3ccccc34)cc2c1.
What is the InChIKey of 6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline?
The InChIKey is SXXLPMHKOBVYPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H14N2S/c1-4-10-18-15(7-1)13-20-23(22-14-16-8-2-6-12-21(16)26-22)24-17-9-3-5-11-19(17)25(18)20/h1-14H.
What are the key properties of 6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline?
6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline has a molecular weight of 350.45 g/mol, XLogP of 6.52, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-benzothiophen-2-yl)indolo[1,2-a]quinoxaline is sourced from PubChem (CID 162406863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).