11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine

C24H19BrN2 — CID 154611098

IUPAC11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine
SMILESCc1cc(C)c(-c2ccc3c(c2)c2ccc(Br)cc2c2nccn32)c(C)c1
InChIInChI=1S/C24H19BrN2/c1-14-10-15(2)23(16(3)11-14)17-4-7-22-20(12-17)19-6-5-18(25)13-21(19)24-26-8-9-27(22)24/h4-13H,1-3H3
InChIKeyLQNLLBJJKDZARV-UHFFFAOYSA-N
MW415.33 g/mol
LogP7.00
Rot. Bonds1

About 11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine

11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine (PubChem CID 154611098) has the molecular formula C24H19BrN2 and a molecular weight of 415.33 g/mol. Its IUPAC name is 11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine.

Molecular Properties

Compound Name11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine
PubChem CID154611098
Molecular FormulaC24H19BrN2
Molecular Weight415.33 g/mol
Exact Mass414.07
IUPAC Name11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine
SMILESCc1cc(C)c(-c2ccc3c(c2)c2ccc(Br)cc2c2nccn32)c(C)c1
InChIInChI=1S/C24H19BrN2/c1-14-10-15(2)23(16(3)11-14)17-4-7-22-20(12-17)19-6-5-18(25)13-21(19)24-26-8-9-27(22)24/h4-13H,1-3H3
InChIKeyLQNLLBJJKDZARV-UHFFFAOYSA-N
XLogP7.00
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.33
LogP ≤ 57.00
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

11-bromo-6,7-dimethylimidazo[1,2-f]phenanthridine
CID 135379707
11-bromo-7-tert-butylimidazo[1,2-f]phenanthridine
CID 154610318
CID 160896709
CID 160896709
7,10-dimethylimidazo[1,2-f]phenanthridine
CID 58943988
11-(9-pyridin-2-ylcarbazol-2-yl)oxy-6-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine
CID 154610805
6,7-dimethylimidazo[1,2-f]phenanthridin-11-ol
CID 135379703
5,7-bis(2,6-dimethylphenyl)-11-imidazo[1,2-f]phenanthridin-11-yloxyimidazo[1,2-f]phenanthridine
CID 170672592
2,7-dibromo-9,10-bis(2,4,6-trimethylphenyl)anthracene
CID 122211762
9-(7-phenylimidazo[1,2-f]phenanthridin-11-yl)oxy-2,5,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7(12),8,10,14,16-octaene
CID 154610709
6-(2,6-dimethylphenyl)-11-[[7-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]oxy]-12H-imidazo[1,2-f]phenanthridin-12-ide;platinum(2+)
CID 154611141
2-bromo-4-(2,4,6-trimethylphenyl)pyridine
CID 168984492
5-(2,4,6-trimethylphenyl)imidazo[2,1-a]isoquinoline
CID 58517975

Frequently Asked Questions

What is the IUPAC name of 11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine?
The IUPAC name of 11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine (CID 154611098) is 11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine.
What is the SMILES notation for 11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine?
The canonical SMILES for 11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine is Cc1cc(C)c(-c2ccc3c(c2)c2ccc(Br)cc2c2nccn32)c(C)c1.
What is the InChIKey of 11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine?
The InChIKey is LQNLLBJJKDZARV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19BrN2/c1-14-10-15(2)23(16(3)11-14)17-4-7-22-20(12-17)19-6-5-18(25)13-21(19)24-26-8-9-27(22)24/h4-13H,1-3H3.
What are the key properties of 11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine?
11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine has a molecular weight of 415.33 g/mol, XLogP of 7.00, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-bromo-7-(2,4,6-trimethylphenyl)imidazo[1,2-f]phenanthridine is sourced from PubChem (CID 154611098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).