1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole

C50H34N4 — CID 140933249

IUPAC1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole
SMILESc1ccc(-c2c(-c3ccccc3)n(-c3ccc4c(-c5ccccc5)c(-c5ccccc5)n(-c5ccccn5)c4c3)c3cc(-c4ccccn4)ccc23)cc1
InChIInChI=1S/C50H34N4/c1-5-17-35(18-6-1)47-41-29-27-39(43-25-13-15-31-51-43)33-44(41)53(49(47)37-21-9-3-10-22-37)40-28-30-42-45(34-40)54(46-26-14-16-32-52-46)50(38-23-11-4-12-24-38)48(42)36-19-7-2-8-20-36/h1-34H
InChIKeyUDFSNMDCDNANEX-UHFFFAOYSA-N
MW690.85 g/mol
LogP12.70
Rot. Bonds7

About 1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole

1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole (PubChem CID 140933249) has the molecular formula C50H34N4 and a molecular weight of 690.85 g/mol. Its IUPAC name is 1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole.

Molecular Properties

Compound Name1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole
PubChem CID140933249
Molecular FormulaC50H34N4
Molecular Weight690.85 g/mol
Exact Mass690.28
IUPAC Name1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole
SMILESc1ccc(-c2c(-c3ccccc3)n(-c3ccc4c(-c5ccccc5)c(-c5ccccc5)n(-c5ccccn5)c4c3)c3cc(-c4ccccn4)ccc23)cc1
InChIInChI=1S/C50H34N4/c1-5-17-35(18-6-1)47-41-29-27-39(43-25-13-15-31-51-43)33-44(41)53(49(47)37-21-9-3-10-22-37)40-28-30-42-45(34-40)54(46-26-14-16-32-52-46)50(38-23-11-4-12-24-38)48(42)36-19-7-2-8-20-36/h1-34H
InChIKeyUDFSNMDCDNANEX-UHFFFAOYSA-N
XLogP12.70
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500690.85
LogP ≤ 512.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole with MolForge

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Related Compounds

2-phenyl-9-(9-pyridin-2-ylcarbazol-2-yl)carbazole
CID 71478701
2-phenyl-1-(2-phenyl-1-pyridin-2-ylindol-6-yl)-6-pyridin-2-ylindole
CID 140933274
5-methoxy-2,3-diphenyl-1-pyridin-2-ylindole
CID 102261827
platinum(2+);9-pyridin-2-yl-2-(2-quinolin-2-ylcarbazol-9-yl)carbazole
CID 71478704
9-pyridin-2-yl-2-(2-pyridin-2-ylcarbazol-9-yl)pyrido[2,3-b]indole
CID 155655282
20-[9-(4-tert-butyl-2-pyridinyl)carbazol-2-yl]-17-pyridin-2-yl-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14(19),15,17,21,23-dodecaene
CID 163456260
2-[4-(4-phenylphenyl)-2-pyridinyl]-9-(3-pyridin-2-ylphenyl)carbazole
CID 140825608
2-pyridin-2-yl-11-(9-pyridin-2-ylcarbazol-2-yl)benzo[b][1]benzazepine
CID 90089781
6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine
CID 160823432
5,7-diphenyl-2,10-dipyridin-2-ylindolo[2,3-b]carbazole
CID 130417472
N-phenyl-N-[3-(4-phenyl-2-pyridinyl)phenyl]-1,2,3-tripyridin-2-ylindol-6-amine
CID 140933293
4-(2,7-dipyridin-2-ylcarbazol-9-yl)-2-(4-phenylphenyl)isoindole-1,3-dione
CID 142280587

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole?
The IUPAC name of 1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole (CID 140933249) is 1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole.
What is the SMILES notation for 1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole?
The canonical SMILES for 1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole is c1ccc(-c2c(-c3ccccc3)n(-c3ccc4c(-c5ccccc5)c(-c5ccccc5)n(-c5ccccn5)c4c3)c3cc(-c4ccccn4)ccc23)cc1.
What is the InChIKey of 1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole?
The InChIKey is UDFSNMDCDNANEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H34N4/c1-5-17-35(18-6-1)47-41-29-27-39(43-25-13-15-31-51-43)33-44(41)53(49(47)37-21-9-3-10-22-37)40-28-30-42-45(34-40)54(46-26-14-16-32-52-46)50(38-23-11-4-12-24-38)48(42)36-19-7-2-8-20-36/h1-34H.
What are the key properties of 1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole?
1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole has a molecular weight of 690.85 g/mol, XLogP of 12.70, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-diphenyl-1-pyridin-2-ylindol-6-yl)-2,3-diphenyl-6-pyridin-2-ylindole is sourced from PubChem (CID 140933249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).