9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole

C45H29N5 — CID 129221784

IUPAC9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
SMILESc1ccc(-n2c3ccccc3c3c(-c4ccc5c6cccnc6n(-c6cc(-c7ccccn7)cc(-c7ccccn7)c6)c5c4)cccc32)cc1
InChIInChI=1S/C45H29N5/c1-2-12-33(13-3-1)49-41-19-5-4-14-38(41)44-35(15-10-20-42(44)49)30-21-22-36-37-16-11-25-48-45(37)50(43(36)29-30)34-27-31(39-17-6-8-23-46-39)26-32(28-34)40-18-7-9-24-47-40/h1-29H
InChIKeyGBYBSYJDCXMUHQ-UHFFFAOYSA-N
MW639.76 g/mol
LogP11.07
Rot. Bonds5

About 9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole

9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole (PubChem CID 129221784) has the molecular formula C45H29N5 and a molecular weight of 639.76 g/mol. Its IUPAC name is 9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole.

Molecular Properties

Compound Name9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
PubChem CID129221784
Molecular FormulaC45H29N5
Molecular Weight639.76 g/mol
Exact Mass639.24
IUPAC Name9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
SMILESc1ccc(-n2c3ccccc3c3c(-c4ccc5c6cccnc6n(-c6cc(-c7ccccn7)cc(-c7ccccn7)c6)c5c4)cccc32)cc1
InChIInChI=1S/C45H29N5/c1-2-12-33(13-3-1)49-41-19-5-4-14-38(41)44-35(15-10-20-42(44)49)30-21-22-36-37-16-11-25-48-45(37)50(43(36)29-30)34-27-31(39-17-6-8-23-46-39)26-32(28-34)40-18-7-9-24-47-40/h1-29H
InChIKeyGBYBSYJDCXMUHQ-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

9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-2-yl)pyrido[2,3-b]indole
CID 129221618
9-(3,5-dipyridin-2-ylphenyl)-6-(9-phenylcarbazol-2-yl)pyrido[2,3-b]indole
CID 118587520
9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
CID 118587050
7-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
CID 129221779
9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]-6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole;9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
CID 158404712
7-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;7-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;7-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-4-yl]pyrido[2,3-b]indole
CID 161116554
6-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;6-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;6-[9-[3-(3,5-dipyridin-2-ylphenyl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
CID 159460585
9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole;7-(9-phenylcarbazol-4-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole
CID 158937746
7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole
CID 129221411
6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
CID 129221841
9-(3-phenyl-5-pyridin-2-ylphenyl)pyrido[2,3-b]indole
CID 158284892
5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole
CID 118587992

Frequently Asked Questions

What is the IUPAC name of 9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole?
The IUPAC name of 9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole (CID 129221784) is 9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole.
What is the SMILES notation for 9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole?
The canonical SMILES for 9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole is c1ccc(-n2c3ccccc3c3c(-c4ccc5c6cccnc6n(-c6cc(-c7ccccn7)cc(-c7ccccn7)c6)c5c4)cccc32)cc1.
What is the InChIKey of 9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole?
The InChIKey is GBYBSYJDCXMUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H29N5/c1-2-12-33(13-3-1)49-41-19-5-4-14-38(41)44-35(15-10-20-42(44)49)30-21-22-36-37-16-11-25-48-45(37)50(43(36)29-30)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 9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole?
9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-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 9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole is sourced from PubChem (CID 129221784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).