3,5-dibromoimidazo[1,2-f]phenanthridine

C15H8Br2N2 — CID 118915715

IUPAC3,5-dibromoimidazo[1,2-f]phenanthridine
SMILESBrc1cccc2c3ccccc3c3ncc(Br)n3c12
InChIInChI=1S/C15H8Br2N2/c16-12-7-3-6-10-9-4-1-2-5-11(9)15-18-8-13(17)19(15)14(10)12/h1-8H
InChIKeyTVUKVYHBAVEUOH-UHFFFAOYSA-N
MW376.05 g/mol
LogP5.17
Rot. Bonds

About 3,5-dibromoimidazo[1,2-f]phenanthridine

3,5-dibromoimidazo[1,2-f]phenanthridine (PubChem CID 118915715) has the molecular formula C15H8Br2N2 and a molecular weight of 376.05 g/mol. Its IUPAC name is 3,5-dibromoimidazo[1,2-f]phenanthridine.

Molecular Properties

Compound Name3,5-dibromoimidazo[1,2-f]phenanthridine
PubChem CID118915715
Molecular FormulaC15H8Br2N2
Molecular Weight376.05 g/mol
Exact Mass373.91
IUPAC Name3,5-dibromoimidazo[1,2-f]phenanthridine
SMILESBrc1cccc2c3ccccc3c3ncc(Br)n3c12
InChIInChI=1S/C15H8Br2N2/c16-12-7-3-6-10-9-4-1-2-5-11(9)15-18-8-13(17)19(15)14(10)12/h1-8H
InChIKeyTVUKVYHBAVEUOH-UHFFFAOYSA-N
XLogP5.17
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.05
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,5-dibromoimidazo[1,2-f]phenanthridine?
The IUPAC name of 3,5-dibromoimidazo[1,2-f]phenanthridine (CID 118915715) is 3,5-dibromoimidazo[1,2-f]phenanthridine.
What is the SMILES notation for 3,5-dibromoimidazo[1,2-f]phenanthridine?
The canonical SMILES for 3,5-dibromoimidazo[1,2-f]phenanthridine is Brc1cccc2c3ccccc3c3ncc(Br)n3c12.
What is the InChIKey of 3,5-dibromoimidazo[1,2-f]phenanthridine?
The InChIKey is TVUKVYHBAVEUOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8Br2N2/c16-12-7-3-6-10-9-4-1-2-5-11(9)15-18-8-13(17)19(15)14(10)12/h1-8H.
What are the key properties of 3,5-dibromoimidazo[1,2-f]phenanthridine?
3,5-dibromoimidazo[1,2-f]phenanthridine has a molecular weight of 376.05 g/mol, XLogP of 5.17, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromoimidazo[1,2-f]phenanthridine is sourced from PubChem (CID 118915715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).