5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole

C42H28N2 — CID 168727741

IUPAC5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4cc5c(c(-c6ccccc6)c43)c3ccccc3n5-c3ccccc3)c2)cc1
InChIInChI=1S/C42H28N2/c1-4-15-29(16-5-1)31-19-14-22-33(27-31)44-37-25-12-10-23-34(37)36-28-39-41(40(42(36)44)30-17-6-2-7-18-30)35-24-11-13-26-38(35)43(39)32-20-8-3-9-21-32/h1-28H
InChIKeyHZBFYBJNVKDOKW-UHFFFAOYSA-N
MW560.70 g/mol
LogP11.21
Rot. Bonds4

About 5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole

5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole (PubChem CID 168727741) has the molecular formula C42H28N2 and a molecular weight of 560.70 g/mol. Its IUPAC name is 5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole.

Molecular Properties

Compound Name5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole
PubChem CID168727741
Molecular FormulaC42H28N2
Molecular Weight560.70 g/mol
Exact Mass560.23
IUPAC Name5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4cc5c(c(-c6ccccc6)c43)c3ccccc3n5-c3ccccc3)c2)cc1
InChIInChI=1S/C42H28N2/c1-4-15-29(16-5-1)31-19-14-22-33(27-31)44-37-25-12-10-23-34(37)36-28-39-41(40(42(36)44)30-17-6-2-7-18-30)35-24-11-13-26-38(35)43(39)32-20-8-3-9-21-32/h1-28H
InChIKeyHZBFYBJNVKDOKW-UHFFFAOYSA-N
XLogP11.21
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500560.70
LogP ≤ 511.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

10,29-bis(3-phenylphenyl)-1,10,20,29-tetrazaundecacyclo[19.17.1.12,13.03,11.04,9.014,19.022,30.023,28.032,39.033,38.020,40]tetraconta-2(40),3(11),4,6,8,12,14,16,18,21(39),22(30),23,25,27,31,33,35,37-octadecaene
CID 171595229
11,12-diphenyl-5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[3,2-b]carbazole
CID 170255530
11-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-5,12-diphenylindolo[3,2-b]carbazole
CID 170255532
9,18-diphenyl-27-[3-(4-phenylphenyl)phenyl]-9,18,27-triazaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene
CID 138730085
12-(4-carbazol-9-ylphenyl)-5-(3-phenylphenyl)indolo[3,2-c]carbazole
CID 134168741
5-phenyl-12-[3-(3-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 153011834
9-[3-(3-carbazol-9-ylphenyl)phenyl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 134168669
9-[3-(3-carbazol-9-ylphenyl)phenyl]-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-[3-(4-carbazol-9-ylphenyl)phenyl]-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-[4-(3-carbazol-9-ylphenyl)phenyl]-14-(3-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 158065664
5-(3-phenylphenyl)-12-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 126656172
12-(3-phenylphenyl)-5-[4-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 122598833
12-[3-(4-carbazol-9-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 134168746
5,12-bis[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 122598848

Frequently Asked Questions

What is the IUPAC name of 5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole?
The IUPAC name of 5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole (CID 168727741) is 5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole.
What is the SMILES notation for 5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole?
The canonical SMILES for 5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole is c1ccc(-c2cccc(-n3c4ccccc4c4cc5c(c(-c6ccccc6)c43)c3ccccc3n5-c3ccccc3)c2)cc1.
What is the InChIKey of 5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole?
The InChIKey is HZBFYBJNVKDOKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28N2/c1-4-15-29(16-5-1)31-19-14-22-33(27-31)44-37-25-12-10-23-34(37)36-28-39-41(40(42(36)44)30-17-6-2-7-18-30)35-24-11-13-26-38(35)43(39)32-20-8-3-9-21-32/h1-28H.
What are the key properties of 5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole?
5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole has a molecular weight of 560.70 g/mol, XLogP of 11.21, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole is sourced from PubChem (CID 168727741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).