10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid

C16H9BrN2O2 — CID 122181014

IUPAC10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid
SMILESO=C(O)c1nc2ccccc2c2[nH]c3c(Br)cccc3c12
InChIInChI=1S/C16H9BrN2O2/c17-10-6-3-5-9-12-14(19-13(9)10)8-4-1-2-7-11(8)18-15(12)16(20)21/h1-7,19H,(H,20,21)
InChIKeyPCUWPDUAQBAWHT-UHFFFAOYSA-N
MW341.16 g/mol
LogP4.33
Rot. Bonds1

About 10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid

10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid (PubChem CID 122181014) has the molecular formula C16H9BrN2O2 and a molecular weight of 341.16 g/mol. Its IUPAC name is 10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid.

Molecular Properties

Compound Name10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid
PubChem CID122181014
Molecular FormulaC16H9BrN2O2
Molecular Weight341.16 g/mol
Exact Mass339.98
IUPAC Name10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid
SMILESO=C(O)c1nc2ccccc2c2[nH]c3c(Br)cccc3c12
InChIInChI=1S/C16H9BrN2O2/c17-10-6-3-5-9-12-14(19-13(9)10)8-4-1-2-7-11(8)18-15(12)16(20)21/h1-7,19H,(H,20,21)
InChIKeyPCUWPDUAQBAWHT-UHFFFAOYSA-N
XLogP4.33
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.16
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid?
The IUPAC name of 10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid (CID 122181014) is 10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid.
What is the SMILES notation for 10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid?
The canonical SMILES for 10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid is O=C(O)c1nc2ccccc2c2[nH]c3c(Br)cccc3c12.
What is the InChIKey of 10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid?
The InChIKey is PCUWPDUAQBAWHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9BrN2O2/c17-10-6-3-5-9-12-14(19-13(9)10)8-4-1-2-7-11(8)18-15(12)16(20)21/h1-7,19H,(H,20,21).
What are the key properties of 10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid?
10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid has a molecular weight of 341.16 g/mol, XLogP of 4.33, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-bromo-11H-indolo[3,2-c]quinoline-6-carboxylic acid is sourced from PubChem (CID 122181014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).