5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole

C79H48N8 — CID 147632522

IUPAC5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole
SMILESc1ccc(-n2c3ccccc3c3cc4c5ccccc5n(-c5cccc(-c6cn7ccc(-c8cccc(-n9c%10ccccc%10c%10cc%11c%12ccccc%12n(-c%12cccc(-c%13ccc%14ccc%15cccnc%15c%14n%13)c%12)c%11cc%109)c8)cc7n6)c5)c4cc32)cc1
InChIInChI=1S/C79H48N8/c1-2-20-55(21-3-1)84-69-29-8-4-25-59(69)63-44-64-61-27-7-11-32-72(61)87(74(64)46-73(63)84)58-24-14-18-54(42-58)68-48-83-39-37-52(43-77(83)81-68)51-16-12-22-56(40-51)85-70-30-9-5-26-60(70)65-45-66-62-28-6-10-31-71(62)86(76(66)47-75(65)85)57-23-13-17-53(41-57)67-36-35-50-34-33-49-19-15-38-80-78(49)79(50)82-67/h1-48H
InChIKeyGFZJGVFUFCMSST-UHFFFAOYSA-N
MW1109.31 g/mol
LogP19.82
Rot. Bonds7

About 5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole

5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole (PubChem CID 147632522) has the molecular formula C79H48N8 and a molecular weight of 1109.31 g/mol. Its IUPAC name is 5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole.

Molecular Properties

Compound Name5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole
PubChem CID147632522
Molecular FormulaC79H48N8
Molecular Weight1109.31 g/mol
Exact Mass1108.40
IUPAC Name5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole
SMILESc1ccc(-n2c3ccccc3c3cc4c5ccccc5n(-c5cccc(-c6cn7ccc(-c8cccc(-n9c%10ccccc%10c%10cc%11c%12ccccc%12n(-c%12cccc(-c%13ccc%14ccc%15cccnc%15c%14n%13)c%12)c%11cc%109)c8)cc7n6)c5)c4cc32)cc1
InChIInChI=1S/C79H48N8/c1-2-20-55(21-3-1)84-69-29-8-4-25-59(69)63-44-64-61-27-7-11-32-72(61)87(74(64)46-73(63)84)58-24-14-18-54(42-58)68-48-83-39-37-52(43-77(83)81-68)51-16-12-22-56(40-51)85-70-30-9-5-26-60(70)65-45-66-62-28-6-10-31-71(62)86(76(66)47-75(65)85)57-23-13-17-53(41-57)67-36-35-50-34-33-49-19-15-38-80-78(49)79(50)82-67/h1-48H
InChIKeyGFZJGVFUFCMSST-UHFFFAOYSA-N
XLogP19.82
TPSA62.80 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms87
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001109.31
LogP ≤ 519.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole 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

N-(2-methyl-5-(quinoxalin-2-yl)phenyl)-7-(pyridin-2-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine
CID 11154615
6-((4-(2-(4-Tert-butylphenyl)imidazo[1,2-a]pyridin-8-yl)piperazin-1-yl)methyl)quinoxaline
CID 15602807
7-Methyl-6-[1-(5-quinolin-3-ylimidazo[4,5-b]pyrazin-3-yl)ethyl]quinoline
CID 86566631
3,6-bis[5-[5-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]-9-[4-(4-methylpiperazin-1-yl)butyl]carbazole
CID 137100819
5-Methyl-6-[1-(5-quinolin-3-ylimidazo[4,5-b]pyrazin-3-yl)ethyl]quinoline
CID 155550628
2,5-Bis[4-(4-pentylphenyl)triazol-1-yl]benzimidazolo[1,2-a]quinoline-6-carbonitrile
CID 155560568
3-Methyl-2-[2-(1,6-naphthyridin-2-yl)ethyl]imidazo[4,5-h]quinoline
CID 54755358
2-[2-(5,8-Dimethyl-1,6-naphthyridin-2-yl)ethyl]-3-methylimidazo[4,5-h]quinoline
CID 54755359
2-[2-(5,8-Dimethylimidazo[1,2-a]pyrazin-2-yl)ethyl]-3-methylimidazo[4,5-f]quinoline
CID 57415016
2-[2-(5,8-Dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]-3-methylimidazo[4,5-f]quinoline
CID 57415141
3-Methyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-h]quinoline
CID 70097412
3-Methyl-2-[2-(1,8-naphthyridin-2-yl)ethyl]imidazo[4,5-f]quinoline
CID 70648747

Frequently Asked Questions

What is the IUPAC name of 5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole?
The IUPAC name of 5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole (CID 147632522) is 5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole.
What is the SMILES notation for 5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole?
The canonical SMILES for 5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole is c1ccc(-n2c3ccccc3c3cc4c5ccccc5n(-c5cccc(-c6cn7ccc(-c8cccc(-n9c%10ccccc%10c%10cc%11c%12ccccc%12n(-c%12cccc(-c%13ccc%14ccc%15cccnc%15c%14n%13)c%12)c%11cc%109)c8)cc7n6)c5)c4cc32)cc1.
What is the InChIKey of 5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole?
The InChIKey is GFZJGVFUFCMSST-UHFFFAOYSA-N. The full InChI is InChI=1S/C79H48N8/c1-2-20-55(21-3-1)84-69-29-8-4-25-59(69)63-44-64-61-27-7-11-32-72(61)87(74(64)46-73(63)84)58-24-14-18-54(42-58)68-48-83-39-37-52(43-77(83)81-68)51-16-12-22-56(40-51)85-70-30-9-5-26-60(70)65-45-66-62-28-6-10-31-71(62)86(76(66)47-75(65)85)57-23-13-17-53(41-57)67-36-35-50-34-33-49-19-15-38-80-78(49)79(50)82-67/h1-48H.
What are the key properties of 5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole?
5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole has a molecular weight of 1109.31 g/mol, XLogP of 19.82, 7 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(1,10-phenanthrolin-2-yl)phenyl]-7-[3-[2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]indolo[2,3-b]carbazole is sourced from PubChem (CID 147632522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).