5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline

C124H74Br12F2N10O2 — CID 173270945

IUPAC5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline
SMILESBrc1c2ccccc2c(Br)c2nc(-c3ccccc3)c(-c3ccccc3)nc12.Brc1ccc(-c2nc3c(Br)c4ccccc4c(Br)c3nc2-c2ccc(Br)cc2)cc1.COc1cccc(-c2nc3c(Br)c4ccccc4c(Br)c3nc2-c2cccc(OC)c2)c1.Cc1ccc(-c2nc3c(Br)c4ccccc4c(Br)c3nc2-c2ccc(C)cc2)cc1.Fc1ccc(-c2nc3c(Br)c4ccccc4c(Br)c3nc2-c2ccc(F)cc2)cc1
InChIInChI=1S/C26H18Br2N2O2.C26H18Br2N2.C24H12Br4N2.C24H12Br2F2N2.C24H14Br2N2/c1-31-17-9-5-7-15(13-17)23-24(16-8-6-10-18(14-16)32-2)30-26-22(28)20-12-4-3-11-19(20)21(27)25(26)29-23;1-15-7-11-17(12-8-15)23-24(18-13-9-16(2)10-14-18)30-26-22(28)20-6-4-3-5-19(20)21(27)25(26)29-23;25-15-9-5-13(6-10-15)21-22(14-7-11-16(26)12-8-14)30-24-20(28)18-4-2-1-3-17(18)19(27)23(24)29-21;25-19-17-3-1-2-4-18(17)20(26)24-23(19)29-21(13-5-9-15(27)10-6-13)22(30-24)14-7-11-16(28)12-8-14;25-19-17-13-7-8-14-18(17)20(26)24-23(19)27-21(15-9-3-1-4-10-15)22(28-24)16-11-5-2-6-12-16/h3-14H,1-2H3;3-14H,1-2H3;2*1-12H;1-14H
InChIKeyQANFYLQOBWISAI-UHFFFAOYSA-N
MW2732.87 g/mol
LogP40.65
Rot. Bonds12

About 5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline

5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline (PubChem CID 173270945) has the molecular formula C124H74Br12F2N10O2 and a molecular weight of 2732.87 g/mol. Its IUPAC name is 5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline.

Molecular Properties

Compound Name5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline
PubChem CID173270945
Molecular FormulaC124H74Br12F2N10O2
Molecular Weight2732.87 g/mol
Exact Mass2719.62
IUPAC Name5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline
SMILESBrc1c2ccccc2c(Br)c2nc(-c3ccccc3)c(-c3ccccc3)nc12.Brc1ccc(-c2nc3c(Br)c4ccccc4c(Br)c3nc2-c2ccc(Br)cc2)cc1.COc1cccc(-c2nc3c(Br)c4ccccc4c(Br)c3nc2-c2cccc(OC)c2)c1.Cc1ccc(-c2nc3c(Br)c4ccccc4c(Br)c3nc2-c2ccc(C)cc2)cc1.Fc1ccc(-c2nc3c(Br)c4ccccc4c(Br)c3nc2-c2ccc(F)cc2)cc1
InChIInChI=1S/C26H18Br2N2O2.C26H18Br2N2.C24H12Br4N2.C24H12Br2F2N2.C24H14Br2N2/c1-31-17-9-5-7-15(13-17)23-24(16-8-6-10-18(14-16)32-2)30-26-22(28)20-12-4-3-11-19(20)21(27)25(26)29-23;1-15-7-11-17(12-8-15)23-24(18-13-9-16(2)10-14-18)30-26-22(28)20-6-4-3-5-19(20)21(27)25(26)29-23;25-15-9-5-13(6-10-15)21-22(14-7-11-16(26)12-8-14)30-24-20(28)18-4-2-1-3-17(18)19(27)23(24)29-21;25-19-17-3-1-2-4-18(17)20(26)24-23(19)29-21(13-5-9-15(27)10-6-13)22(30-24)14-7-11-16(28)12-8-14;25-19-17-13-7-8-14-18(17)20(26)24-23(19)27-21(15-9-3-1-4-10-15)22(28-24)16-11-5-2-6-12-16/h3-14H,1-2H3;3-14H,1-2H3;2*1-12H;1-14H
InChIKeyQANFYLQOBWISAI-UHFFFAOYSA-N
XLogP40.65
TPSA147.36 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms150
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002732.87
LogP ≤ 540.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline?
The IUPAC name of 5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline (CID 173270945) is 5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline.
What is the SMILES notation for 5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline?
The canonical SMILES for 5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline is Brc1c2ccccc2c(Br)c2nc(-c3ccccc3)c(-c3ccccc3)nc12.Brc1ccc(-c2nc3c(Br)c4ccccc4c(Br)c3nc2-c2ccc(Br)cc2)cc1.COc1cccc(-c2nc3c(Br)c4ccccc4c(Br)c3nc2-c2cccc(OC)c2)c1.Cc1ccc(-c2nc3c(Br)c4ccccc4c(Br)c3nc2-c2ccc(C)cc2)cc1.Fc1ccc(-c2nc3c(Br)c4ccccc4c(Br)c3nc2-c2ccc(F)cc2)cc1.
What is the InChIKey of 5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline?
The InChIKey is QANFYLQOBWISAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18Br2N2O2.C26H18Br2N2.C24H12Br4N2.C24H12Br2F2N2.C24H14Br2N2/c1-31-17-9-5-7-15(13-17)23-24(16-8-6-10-18(14-16)32-2)30-26-22(28)20-12-4-3-11-19(20)21(27)25(26)29-23;1-15-7-11-17(12-8-15)23-24(18-13-9-16(2)10-14-18)30-26-22(28)20-6-4-3-5-19(20)21(27)25(26)29-23;25-15-9-5-13(6-10-15)21-22(14-7-11-16(26)12-8-14)30-24-20(28)18-4-2-1-3-17(18)19(27)23(24)29-21;25-19-17-3-1-2-4-18(17)20(26)24-23(19)29-21(13-5-9-15(27)10-6-13)22(30-24)14-7-11-16(28)12-8-14;25-19-17-13-7-8-14-18(17)20(26)24-23(19)27-21(15-9-3-1-4-10-15)22(28-24)16-11-5-2-6-12-16/h3-14H,1-2H3;3-14H,1-2H3;2*1-12H;1-14H.
What are the key properties of 5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline?
5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline has a molecular weight of 2732.87 g/mol, XLogP of 40.65, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5,10-dibromo-2,3-bis(4-bromophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-fluorophenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(3-methoxyphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-bis(4-methylphenyl)benzo[g]quinoxaline;5,10-dibromo-2,3-diphenylbenzo[g]quinoxaline is sourced from PubChem (CID 173270945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).