12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole

C47H32N4 — CID 134240188

IUPAC12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole
SMILESC1=c2c(n(-c3cccc(-c4cccc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccccc8)c7c65)n4)c3)c3ccccc23)=CCC1
InChIInChI=1S/C47H32N4/c1-2-15-32(16-3-1)50-43-25-10-6-20-36(43)38-28-29-39-37-21-7-11-26-44(37)51(47(39)46(38)50)45-27-13-22-40(48-45)31-14-12-17-33(30-31)49-41-23-8-4-18-34(41)35-19-5-9-24-42(35)49/h1-4,6-8,10-30H,5,9H2
InChIKeyRBNDKBAERTUHHU-UHFFFAOYSA-N
MW652.80 g/mol
LogP10.24
Rot. Bonds4

About 12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole

12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole (PubChem CID 134240188) has the molecular formula C47H32N4 and a molecular weight of 652.80 g/mol. Its IUPAC name is 12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole.

Molecular Properties

Compound Name12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole
PubChem CID134240188
Molecular FormulaC47H32N4
Molecular Weight652.80 g/mol
Exact Mass652.26
IUPAC Name12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole
SMILESC1=c2c(n(-c3cccc(-c4cccc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccccc8)c7c65)n4)c3)c3ccccc23)=CCC1
InChIInChI=1S/C47H32N4/c1-2-15-32(16-3-1)50-43-25-10-6-20-36(43)38-28-29-39-37-21-7-11-26-44(37)51(47(39)46(38)50)45-27-13-22-40(48-45)31-14-12-17-33(30-31)49-41-23-8-4-18-34(41)35-19-5-9-24-42(35)49/h1-4,6-8,10-30H,5,9H2
InChIKeyRBNDKBAERTUHHU-UHFFFAOYSA-N
XLogP10.24
TPSA27.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500652.80
LogP ≤ 510.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]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

11-[3-(3-phenylphenyl)phenyl]-12-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazole
CID 170268381
12-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-11-(3-phenylphenyl)indolo[2,3-a]carbazole
CID 58570101
11-phenyl-12-[6-(4-phenylphenyl)-2-pyridinyl]indolo[2,3-a]carbazole
CID 134240187
5,12-bis[6-(3-carbazol-9-ylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole
CID 58570039
12-(6-carbazol-9-yl-2-pyridinyl)-11-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole
CID 118041124
11-[3-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-2-pyridinyl]phenyl]benzo[a]carbazole
CID 144568618
12-[3-(6-carbazol-9-yl-2-pyridinyl)phenyl]-11-[3-[6-(6H-cyclohepta[b]indol-5-yl)-2-pyridinyl]phenyl]indolo[2,3-a]carbazole
CID 129209235
9-[3-[3-[3,5-bis(3-carbazol-9-ylphenyl)phenyl]-5-[3-(2,3-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole
CID 163995412
11,12-bis(4-phenylphenyl)indolo[2,3-a]carbazole;5-(3-carbazol-9-ylphenyl)-11,12-diphenylindolo[2,3-a]carbazole;5-(4-carbazol-9-ylphenyl)-11,12-diphenylindolo[2,3-a]carbazole;11-phenyl-12-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazole
CID 160763291
5-phenyl-12-[3-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[4-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[4-[4-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[3-[12-(3-phenylphenyl)indolo[3,2-c]carbazol-5-yl]phenyl]indolo[3,2-c]carbazole;12-phenyl-5-[3-[5-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazol-12-yl]phenyl]indolo[3,2-c]carbazole;5-(6-phenyl-2-pyridinyl)-12-[3-[12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazol-5-yl]phenyl]indolo[3,2-c]carbazole
CID 160727594
12-(6-phenyl-2-pyridinyl)-11-(4-triphenylen-1-ylphenyl)indolo[2,3-a]carbazole
CID 118150729
5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;12-phenyl-5-(4-phenylphenyl)indolo[3,2-c]carbazole;5-(4-phenylphenyl)-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole
CID 158271663

Frequently Asked Questions

What is the IUPAC name of 12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole?
The IUPAC name of 12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole (CID 134240188) is 12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole.
What is the SMILES notation for 12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole?
The canonical SMILES for 12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole is C1=c2c(n(-c3cccc(-c4cccc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccccc8)c7c65)n4)c3)c3ccccc23)=CCC1.
What is the InChIKey of 12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole?
The InChIKey is RBNDKBAERTUHHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H32N4/c1-2-15-32(16-3-1)50-43-25-10-6-20-36(43)38-28-29-39-37-21-7-11-26-44(37)51(47(39)46(38)50)45-27-13-22-40(48-45)31-14-12-17-33(30-31)49-41-23-8-4-18-34(41)35-19-5-9-24-42(35)49/h1-4,6-8,10-30H,5,9H2.
What are the key properties of 12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole?
12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole has a molecular weight of 652.80 g/mol, XLogP of 10.24, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 12-[6-[3-(2,3-dihydrocarbazol-9-yl)phenyl]-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole is sourced from PubChem (CID 134240188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).