6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline

C19H11ClN2S — CID 118970860

IUPAC6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline
SMILESClc1ccc(-c2nc3ccccc3c3cc4ccccn4c23)s1
InChIInChI=1S/C19H11ClN2S/c20-17-9-8-16(23-17)18-19-14(11-12-5-3-4-10-22(12)19)13-6-1-2-7-15(13)21-18/h1-11H
InChIKeyRCPCPTILWIXAGO-UHFFFAOYSA-N
MW334.83 g/mol
LogP6.02
Rot. Bonds1

About 6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline

6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline (PubChem CID 118970860) has the molecular formula C19H11ClN2S and a molecular weight of 334.83 g/mol. Its IUPAC name is 6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline.

Molecular Properties

Compound Name6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline
PubChem CID118970860
Molecular FormulaC19H11ClN2S
Molecular Weight334.83 g/mol
Exact Mass334.03
IUPAC Name6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline
SMILESClc1ccc(-c2nc3ccccc3c3cc4ccccn4c23)s1
InChIInChI=1S/C19H11ClN2S/c20-17-9-8-16(23-17)18-19-14(11-12-5-3-4-10-22(12)19)13-6-1-2-7-15(13)21-18/h1-11H
InChIKeyRCPCPTILWIXAGO-UHFFFAOYSA-N
XLogP6.02
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.83
LogP ≤ 56.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline?
The IUPAC name of 6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline (CID 118970860) is 6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline.
What is the SMILES notation for 6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline?
The canonical SMILES for 6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline is Clc1ccc(-c2nc3ccccc3c3cc4ccccn4c23)s1.
What is the InChIKey of 6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline?
The InChIKey is RCPCPTILWIXAGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11ClN2S/c20-17-9-8-16(23-17)18-19-14(11-12-5-3-4-10-22(12)19)13-6-1-2-7-15(13)21-18/h1-11H.
What are the key properties of 6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline?
6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline has a molecular weight of 334.83 g/mol, XLogP of 6.02, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-chlorothiophen-2-yl)indolizino[3,2-c]quinoline is sourced from PubChem (CID 118970860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).