5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole

C119H78N14 — CID 161189903

IUPAC5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole
SMILESC1=Cc2ccccc2C2CC=C(c3cccc(-c4cccc(-n5c6ccccc6c6ncccc65)c4)n3)C=C12.c1cc(-c2ccc(-c3cccc(-c4ccc(-n5c6ccccc6c6cnccc65)cc4)n3)nc2)cc(-n2c3ccccc3c3cnccc32)c1.c1cc(-c2cccc(-c3cccc(-n4c5ccccc5c5cnccc54)c3)n2)cc(-n2c3ccccc3c3cnccc32)c1
InChIInChI=1S/C44H28N6.C39H25N5.C36H25N3/c1-3-13-41-34(9-1)36-27-45-23-21-43(36)49(41)32-18-15-29(16-19-32)38-11-6-12-40(48-38)39-20-17-31(26-47-39)30-7-5-8-33(25-30)50-42-14-4-2-10-35(42)37-28-46-24-22-44(37)50;1-3-16-36-30(12-1)32-24-40-20-18-38(32)43(36)28-10-5-8-26(22-28)34-14-7-15-35(42-34)27-9-6-11-29(23-27)44-37-17-4-2-13-31(37)33-25-41-21-19-39(33)44;1-2-11-29-24(8-1)17-18-25-22-27(19-20-30(25)29)33-14-6-13-32(38-33)26-9-5-10-28(23-26)39-34-15-4-3-12-31(34)36-35(39)16-7-21-37-36/h1-28H;1-25H;1-19,21-23,30H,20H2
InChIKeyUTOQCVCEJFSZDV-UHFFFAOYSA-N
MW1704.03 g/mol
LogP28.63
Rot. Bonds12

About 5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole

5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole (PubChem CID 161189903) has the molecular formula C119H78N14 and a molecular weight of 1704.03 g/mol. Its IUPAC name is 5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole.

Molecular Properties

Compound Name5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole
PubChem CID161189903
Molecular FormulaC119H78N14
Molecular Weight1704.03 g/mol
Exact Mass1702.65
IUPAC Name5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole
SMILESC1=Cc2ccccc2C2CC=C(c3cccc(-c4cccc(-n5c6ccccc6c6ncccc65)c4)n3)C=C12.c1cc(-c2ccc(-c3cccc(-c4ccc(-n5c6ccccc6c6cnccc65)cc4)n3)nc2)cc(-n2c3ccccc3c3cnccc32)c1.c1cc(-c2cccc(-c3cccc(-n4c5ccccc5c5cnccc54)c3)n2)cc(-n2c3ccccc3c3cnccc32)c1
InChIInChI=1S/C44H28N6.C39H25N5.C36H25N3/c1-3-13-41-34(9-1)36-27-45-23-21-43(36)49(41)32-18-15-29(16-19-32)38-11-6-12-40(48-38)39-20-17-31(26-47-39)30-7-5-8-33(25-30)50-42-14-4-2-10-35(42)37-28-46-24-22-44(37)50;1-3-16-36-30(12-1)32-24-40-20-18-38(32)43(36)28-10-5-8-26(22-28)34-14-7-15-35(42-34)27-9-6-11-29(23-27)44-37-17-4-2-13-31(37)33-25-41-21-19-39(33)44;1-2-11-29-24(8-1)17-18-25-22-27(19-20-30(25)29)33-14-6-13-32(38-33)26-9-5-10-28(23-26)39-34-15-4-3-12-31(34)36-35(39)16-7-21-37-36/h1-28H;1-25H;1-19,21-23,30H,20H2
InChIKeyUTOQCVCEJFSZDV-UHFFFAOYSA-N
XLogP28.63
TPSA140.66 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds12
Heavy Atoms133
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001704.03
LogP ≤ 528.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole 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

5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[6-(3-carbazol-9-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[4-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 159364715
5-[3-[6-[5-(4-pyrido[3,2-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 58099053
5-[3-[6-[6-(3-pyrido[3,4-b]indol-9-ylphenyl)-2-pyridinyl]-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-[6-(3-pyrido[3,4-b]indol-9-ylphenyl)-2-pyridinyl]-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-2-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 158851264
5-[4-[6-[6-(4-pyrido[3,2-b]indol-5-ylphenyl)-2-pyridinyl]-2-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 58098979
5-[3-[6-[6-[4-(azeto[3,2-b]indol-3-yl)phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 163853559
9-[4-[6-[5-(10-naphthalen-2-ylanthracen-9-yl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[2,3-b]indole;5-[4-[6-[5-(10-phenylanthracen-9-yl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[6-[5-(10-phenylanthracen-9-yl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[6-[5-(10-phenylanthracen-9-yl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[2,3-b]indole;9-[4-[6-[5-(10-phenylanthracen-9-yl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[3,4-b]indole
CID 158882618
5-[3-[6-[5-[4-(1,2-dihydropyrido[3,2-b]indol-5-yl)phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[3,2-b]indole
CID 67966056
6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole
CID 161031543
5-[3-[2-(4-phenylphenyl)-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 59326106
5-[3-[6-pyridin-2-yl-4-[10-(4-pyrido[4,3-b]indol-5-ylphenyl)anthracen-9-yl]-2-pyridinyl]phenyl]pyrido[4,3-b]indole
CID 89119653
8-[4-[4-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 118517438
5-[3-[4-(4-methylphenyl)-6-pyridin-2-yl-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;9-[3-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)phenyl]pyrido[3,4-b]indole;9-[3-[2-pyridin-2-yl-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]phenyl]pyrido[2,3-b]indole
CID 162122463

Frequently Asked Questions

What is the IUPAC name of 5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole?
The IUPAC name of 5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole (CID 161189903) is 5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole.
What is the SMILES notation for 5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole?
The canonical SMILES for 5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole is C1=Cc2ccccc2C2CC=C(c3cccc(-c4cccc(-n5c6ccccc6c6ncccc65)c4)n3)C=C12.c1cc(-c2ccc(-c3cccc(-c4ccc(-n5c6ccccc6c6cnccc65)cc4)n3)nc2)cc(-n2c3ccccc3c3cnccc32)c1.c1cc(-c2cccc(-c3cccc(-n4c5ccccc5c5cnccc54)c3)n2)cc(-n2c3ccccc3c3cnccc32)c1.
What is the InChIKey of 5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole?
The InChIKey is UTOQCVCEJFSZDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H28N6.C39H25N5.C36H25N3/c1-3-13-41-34(9-1)36-27-45-23-21-43(36)49(41)32-18-15-29(16-19-32)38-11-6-12-40(48-38)39-20-17-31(26-47-39)30-7-5-8-33(25-30)50-42-14-4-2-10-35(42)37-28-46-24-22-44(37)50;1-3-16-36-30(12-1)32-24-40-20-18-38(32)43(36)28-10-5-8-26(22-28)34-14-7-15-35(42-34)27-9-6-11-29(23-27)44-37-17-4-2-13-31(37)33-25-41-21-19-39(33)44;1-2-11-29-24(8-1)17-18-25-22-27(19-20-30(25)29)33-14-6-13-32(38-33)26-9-5-10-28(23-26)39-34-15-4-3-12-31(34)36-35(39)16-7-21-37-36/h1-28H;1-25H;1-19,21-23,30H,20H2.
What are the key properties of 5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole?
5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole has a molecular weight of 1704.03 g/mol, XLogP of 28.63, 12 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[6-(4,4a-dihydrophenanthren-2-yl)-2-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[3-[6-(3-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]phenyl]pyrido[4,3-b]indole;5-[3-[6-[6-(4-pyrido[4,3-b]indol-5-ylphenyl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole is sourced from PubChem (CID 161189903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).