6-(4-bromophenyl)indolizino[3,2-c]quinoline

C21H13BrN2 — CID 118970875

IUPAC6-(4-bromophenyl)indolizino[3,2-c]quinoline
SMILESBrc1ccc(-c2nc3ccccc3c3cc4ccccn4c23)cc1
InChIInChI=1S/C21H13BrN2/c22-15-10-8-14(9-11-15)20-21-18(13-16-5-3-4-12-24(16)21)17-6-1-2-7-19(17)23-20/h1-13H
InChIKeyRWLYCMOZIXXXJC-UHFFFAOYSA-N
MW373.25 g/mol
LogP6.07
Rot. Bonds1

About 6-(4-bromophenyl)indolizino[3,2-c]quinoline

6-(4-bromophenyl)indolizino[3,2-c]quinoline (PubChem CID 118970875) has the molecular formula C21H13BrN2 and a molecular weight of 373.25 g/mol. Its IUPAC name is 6-(4-bromophenyl)indolizino[3,2-c]quinoline.

Molecular Properties

Compound Name6-(4-bromophenyl)indolizino[3,2-c]quinoline
PubChem CID118970875
Molecular FormulaC21H13BrN2
Molecular Weight373.25 g/mol
Exact Mass372.03
IUPAC Name6-(4-bromophenyl)indolizino[3,2-c]quinoline
SMILESBrc1ccc(-c2nc3ccccc3c3cc4ccccn4c23)cc1
InChIInChI=1S/C21H13BrN2/c22-15-10-8-14(9-11-15)20-21-18(13-16-5-3-4-12-24(16)21)17-6-1-2-7-19(17)23-20/h1-13H
InChIKeyRWLYCMOZIXXXJC-UHFFFAOYSA-N
XLogP6.07
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.25
LogP ≤ 56.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(4-bromophenyl)indolizino[3,2-c]quinoline?
The IUPAC name of 6-(4-bromophenyl)indolizino[3,2-c]quinoline (CID 118970875) is 6-(4-bromophenyl)indolizino[3,2-c]quinoline.
What is the SMILES notation for 6-(4-bromophenyl)indolizino[3,2-c]quinoline?
The canonical SMILES for 6-(4-bromophenyl)indolizino[3,2-c]quinoline is Brc1ccc(-c2nc3ccccc3c3cc4ccccn4c23)cc1.
What is the InChIKey of 6-(4-bromophenyl)indolizino[3,2-c]quinoline?
The InChIKey is RWLYCMOZIXXXJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13BrN2/c22-15-10-8-14(9-11-15)20-21-18(13-16-5-3-4-12-24(16)21)17-6-1-2-7-19(17)23-20/h1-13H.
What are the key properties of 6-(4-bromophenyl)indolizino[3,2-c]quinoline?
6-(4-bromophenyl)indolizino[3,2-c]quinoline has a molecular weight of 373.25 g/mol, XLogP of 6.07, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-bromophenyl)indolizino[3,2-c]quinoline is sourced from PubChem (CID 118970875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).