7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole

C45H29N5 — CID 129221411

IUPAC7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole
SMILESc1ccc(-n2c3cc(-c4cccc5c6ccccc6n(-c6cc(-c7ccccn7)cc(-c7ccccn7)c6)c45)ccc3c3ncccc32)cc1
InChIInChI=1S/C45H29N5/c1-2-12-33(13-3-1)49-42-20-11-25-48-44(42)38-22-21-30(29-43(38)49)35-15-10-16-37-36-14-4-5-19-41(36)50(45(35)37)34-27-31(39-17-6-8-23-46-39)26-32(28-34)40-18-7-9-24-47-40/h1-29H
InChIKeyCDFWHQTXZJSJNN-UHFFFAOYSA-N
MW639.76 g/mol
LogP11.07
Rot. Bonds5

About 7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole

7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole (PubChem CID 129221411) has the molecular formula C45H29N5 and a molecular weight of 639.76 g/mol. Its IUPAC name is 7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole.

Molecular Properties

Compound Name7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole
PubChem CID129221411
Molecular FormulaC45H29N5
Molecular Weight639.76 g/mol
Exact Mass639.24
IUPAC Name7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole
SMILESc1ccc(-n2c3cc(-c4cccc5c6ccccc6n(-c6cc(-c7ccccn7)cc(-c7ccccn7)c6)c45)ccc3c3ncccc32)cc1
InChIInChI=1S/C45H29N5/c1-2-12-33(13-3-1)49-42-20-11-25-48-44(42)38-22-21-30(29-43(38)49)35-15-10-16-37-36-14-4-5-19-41(36)50(45(35)37)34-27-31(39-17-6-8-23-46-39)26-32(28-34)40-18-7-9-24-47-40/h1-29H
InChIKeyCDFWHQTXZJSJNN-UHFFFAOYSA-N
XLogP11.07
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500639.76
LogP ≤ 511.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-3-yl]-5-phenylpyrido[3,2-b]indole
CID 129221939
7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole
CID 129221390
7-(9-phenylcarbazol-1-yl)-5-(3-phenylphenyl)pyrido[3,2-b]indole;7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole;5-phenyl-7-(9-phenylcarbazol-1-yl)pyrido[3,2-b]indole;5-(3-phenylphenyl)-7-[9-(4-phenylphenyl)carbazol-1-yl]pyrido[3,2-b]indole
CID 158647779
5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole
CID 158151336
7-[9-[3-(3,5-dipyridin-2-ylphenyl)phenyl]carbazol-3-yl]-5-phenylpyrido[3,2-b]indole
CID 129221946
5-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,2-b]indole
CID 129221488
9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
CID 129221784
9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-2-yl)pyrido[2,3-b]indole
CID 129221618
5-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-7-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole
CID 118587835
5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole
CID 118587992
8-[9-[3-(3,5-dipyridin-2-ylphenyl)phenyl]carbazol-3-yl]-5-phenylpyrido[3,2-b]indole
CID 129221984
7-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]-5-phenylpyrido[3,2-b]indole;7-[9-[3-(3,5-dipyridin-2-ylphenyl)phenyl]carbazol-3-yl]-5-phenylpyrido[3,2-b]indole;7-[9-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-5-phenylpyrido[3,2-b]indole
CID 159163877

Frequently Asked Questions

What is the IUPAC name of 7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole?
The IUPAC name of 7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole (CID 129221411) is 7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole.
What is the SMILES notation for 7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole?
The canonical SMILES for 7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole is c1ccc(-n2c3cc(-c4cccc5c6ccccc6n(-c6cc(-c7ccccn7)cc(-c7ccccn7)c6)c45)ccc3c3ncccc32)cc1.
What is the InChIKey of 7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole?
The InChIKey is CDFWHQTXZJSJNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H29N5/c1-2-12-33(13-3-1)49-42-20-11-25-48-44(42)38-22-21-30(29-43(38)49)35-15-10-16-37-36-14-4-5-19-41(36)50(45(35)37)34-27-31(39-17-6-8-23-46-39)26-32(28-34)40-18-7-9-24-47-40/h1-29H.
What are the key properties of 7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole?
7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole has a molecular weight of 639.76 g/mol, XLogP of 11.07, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole is sourced from PubChem (CID 129221411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).