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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Related Compounds

3-bromo-2,5,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7,9,11,14,16-octaene
CID 140950358
3-bromo-2,5,14-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7,9,11,14,16-octaene
CID 140950757
magnesium;5-bromo-3-(2-chloroethyl)imidazo[1,2-f]phenanthridine;9,19-diazapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2,4,6,8,10,14(18),15-octaene;propane;chloride
CID 158596846
3-bromo-7-dibenzothiophen-1-ylimidazo[1,2-f]phenanthridine
CID 135212475
9,19-diazapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2,4,6,8,10,14(18),15-octaene;2,3-dimethylbutane;ethane
CID 144958721
12,12-dimethyl-9,19-diazapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2,4,6,8,10,14(18),15-octaene
CID 118915726
3-bromo-7-methylimidazo[2,1-a]isoquinoline
CID 115048749
24-(2,6-dimethylphenyl)-22,25-diazahexacyclo[12.11.0.02,11.05,10.015,20.021,25]pentacosa-1(14),2(11),3,5,7,9,12,15,17,19,21,23-dodecaene
CID 140949125
13,13-diphenyl-13λ4-thia-9,19-diazapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(18),2,4,6,8,10,14,16-octaene
CID 144958755
3-(2,6-dibromophenyl)-11-methoxyimidazo[1,2-f]phenanthridine
CID 70654518
23-methyl-18,20-diazaheptacyclo[18.10.1.02,7.08,13.014,19.021,26.027,31]hentriaconta-1(31),2,4,6,8,10,12,14(19),15,17,21(26),22,24,27,29-pentadecaene
CID 170187674
3-bromo-7-chloroimidazo[2,1-a]isoquinoline
CID 115051768

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).