2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine

C103H75BrN8O3 — CID 158998537

IUPAC2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine
SMILESBrc1ccc2oc3ccccc3c2c1.C.N[C@@H]1CCCC[C@H]1N.c1ccc2c(c1)[nH]c1cc3c(cc12)[nH]c1ccc(-n2c4ccccc4c4ccccc42)cc13.c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4cc5c(cc43)c3cc(-n4c6ccccc6c6ccccc64)ccc3n5-c3ccc4oc5ccccc5c4c3)cc12
InChIInChI=1S/C54H31N3O2.C30H19N3.C12H7BrO.C6H14N2.CH4/c1-6-16-45-35(11-1)36-12-2-7-17-46(36)55(45)32-21-24-48-40(27-32)42-31-49-41(30-50(42)57(48)34-23-26-54-44(29-34)39-15-5-10-20-52(39)59-54)37-13-3-8-18-47(37)56(49)33-22-25-53-43(28-33)38-14-4-9-19-51(38)58-53;1-4-10-25-19(7-1)23-16-28-24(17-27(23)31-25)22-15-18(13-14-26(22)32-28)33-29-11-5-2-8-20(29)21-9-3-6-12-30(21)33;13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12;7-5-3-1-2-4-6(5)8;/h1-31H;1-17,31-32H;1-7H;5-6H,1-4,7-8H2;1H4/t;;;5-,6-;/m...1./s1
InChIKeyJRAYBZGTXYAAMN-GUWCEBCKSA-N
MW1552.69 g/mol
LogP28.03
Rot. Bonds4

About 2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine

2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine (PubChem CID 158998537) has the molecular formula C103H75BrN8O3 and a molecular weight of 1552.69 g/mol. Its IUPAC name is 2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine.

Molecular Properties

Compound Name2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine
PubChem CID158998537
Molecular FormulaC103H75BrN8O3
Molecular Weight1552.69 g/mol
Exact Mass1550.51
IUPAC Name2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine
SMILESBrc1ccc2oc3ccccc3c2c1.C.N[C@@H]1CCCC[C@H]1N.c1ccc2c(c1)[nH]c1cc3c(cc12)[nH]c1ccc(-n2c4ccccc4c4ccccc42)cc13.c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4cc5c(cc43)c3cc(-n4c6ccccc6c6ccccc64)ccc3n5-c3ccc4oc5ccccc5c4c3)cc12
InChIInChI=1S/C54H31N3O2.C30H19N3.C12H7BrO.C6H14N2.CH4/c1-6-16-45-35(11-1)36-12-2-7-17-46(36)55(45)32-21-24-48-40(27-32)42-31-49-41(30-50(42)57(48)34-23-26-54-44(29-34)39-15-5-10-20-52(39)59-54)37-13-3-8-18-47(37)56(49)33-22-25-53-43(28-33)38-14-4-9-19-51(38)58-53;1-4-10-25-19(7-1)23-16-28-24(17-27(23)31-25)22-15-18(13-14-26(22)32-28)33-29-11-5-2-8-20(29)21-9-3-6-12-30(21)33;13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12;7-5-3-1-2-4-6(5)8;/h1-31H;1-17,31-32H;1-7H;5-6H,1-4,7-8H2;1H4/t;;;5-,6-;/m...1./s1
InChIKeyJRAYBZGTXYAAMN-GUWCEBCKSA-N
XLogP28.03
TPSA142.76 Ų
H-Bond Donors4
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms115
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001552.69
LogP ≤ 528.03
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 109

Analyze 2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-bromo-N-[4-(1,1-difluoroethoxy)phenyl]-2,3,4,9-tetrahydro-1H-carbazol-1-amine;6-bromo-N-(3,5-dimethylphenyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;6-bromo-N-(3-methylphenyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;6-bromo-N-(4-methylphenyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)benzamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-3-methylbenzamide
CID 161596098
6-bromo-1-[2-(1-fluorocarbazol-9-yl)dibenzofuran-3-yl]-9H-carbazole
CID 172102765
3,6-Dibromo-9-[8-(3,6-dibromocarbazol-9-yl)dibenzofuran-2-yl]carbazole
CID 57958251
5,11-Di(dibenzofuran-2-yl)indolo[3,2-b]carbazole
CID 57997327
5-(4-Carbazol-9-ylphenyl)-11-dibenzofuran-2-ylindolo[3,2-b]carbazole
CID 57997613
5,18-Di(carbazol-9-yl)-9-dibenzofuran-2-yl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15(20),16,18-nonaene
CID 59146928
2,8-di(carbazol-9-yl)-11H-[1]benzofuro[3,2-b]carbazole
CID 59146980
2,10-di(carbazol-9-yl)-5-dibenzofuran-2-yl-7H-indolo[2,3-b]carbazole
CID 59146998
2,8-di(carbazol-9-yl)-5-dibenzofuran-2-yl-11H-indolo[3,2-b]carbazole
CID 59147082
2,8-Di(carbazol-9-yl)-5-dibenzofuran-2-yl-11-phenylindolo[3,2-b]carbazole
CID 59147142
5,18-Di(carbazol-9-yl)-9-dibenzofuran-2-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15(20),16,18-nonaene
CID 59147220
11-Benzyl-2-carbazol-9-yl-5-dibenzofuran-2-ylindolo[3,2-b]carbazole
CID 59147243

Frequently Asked Questions

What is the IUPAC name of 2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine?
The IUPAC name of 2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine (CID 158998537) is 2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine.
What is the SMILES notation for 2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine?
The canonical SMILES for 2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine is Brc1ccc2oc3ccccc3c2c1.C.N[C@@H]1CCCC[C@H]1N.c1ccc2c(c1)[nH]c1cc3c(cc12)[nH]c1ccc(-n2c4ccccc4c4ccccc42)cc13.c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4cc5c(cc43)c3cc(-n4c6ccccc6c6ccccc64)ccc3n5-c3ccc4oc5ccccc5c4c3)cc12.
What is the InChIKey of 2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine?
The InChIKey is JRAYBZGTXYAAMN-GUWCEBCKSA-N. The full InChI is InChI=1S/C54H31N3O2.C30H19N3.C12H7BrO.C6H14N2.CH4/c1-6-16-45-35(11-1)36-12-2-7-17-46(36)55(45)32-21-24-48-40(27-32)42-31-49-41(30-50(42)57(48)34-23-26-54-44(29-34)39-15-5-10-20-52(39)59-54)37-13-3-8-18-47(37)56(49)33-22-25-53-43(28-33)38-14-4-9-19-51(38)58-53;1-4-10-25-19(7-1)23-16-28-24(17-27(23)31-25)22-15-18(13-14-26(22)32-28)33-29-11-5-2-8-20(29)21-9-3-6-12-30(21)33;13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12;7-5-3-1-2-4-6(5)8;/h1-31H;1-17,31-32H;1-7H;5-6H,1-4,7-8H2;1H4/t;;;5-,6-;/m...1./s1.
What are the key properties of 2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine?
2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine has a molecular weight of 1552.69 g/mol, XLogP of 28.03, 4 rotatable bonds, 4 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromodibenzofuran;2-carbazol-9-yl-5,11-di(dibenzofuran-2-yl)indolo[3,2-b]carbazole;2-carbazol-9-yl-5,11-dihydroindolo[3,2-b]carbazole;methane;trans-(1R,2R)-cyclohexane-1,2-diamine is sourced from PubChem (CID 158998537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).