9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole

C34H22N4 — CID 139574913

IUPAC9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole
SMILESc1ccc(-c2cc3c4ccccc4n(-c4cccc(-n5c6ccccc6c6ccccc65)c4)c3cn2)nc1
InChIInChI=1S/C34H22N4/c1-4-16-31-25(12-1)26-13-2-5-17-32(26)37(31)23-10-9-11-24(20-23)38-33-18-6-3-14-27(33)28-21-30(36-22-34(28)38)29-15-7-8-19-35-29/h1-22H
InChIKeyKDSMMJLNOVZGOI-UHFFFAOYSA-N
MW486.58 g/mol
LogP8.34
Rot. Bonds3

About 9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole

9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole (PubChem CID 139574913) has the molecular formula C34H22N4 and a molecular weight of 486.58 g/mol. Its IUPAC name is 9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole.

Molecular Properties

Compound Name9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole
PubChem CID139574913
Molecular FormulaC34H22N4
Molecular Weight486.58 g/mol
Exact Mass486.18
IUPAC Name9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole
SMILESc1ccc(-c2cc3c4ccccc4n(-c4cccc(-n5c6ccccc6c6ccccc65)c4)c3cn2)nc1
InChIInChI=1S/C34H22N4/c1-4-16-31-25(12-1)26-13-2-5-17-32(26)37(31)23-10-9-11-24(20-23)38-33-18-6-3-14-27(33)28-21-30(36-22-34(28)38)29-15-7-8-19-35-29/h1-22H
InChIKeyKDSMMJLNOVZGOI-UHFFFAOYSA-N
XLogP8.34
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.58
LogP ≤ 58.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

9-methyl-3-pyridin-2-ylpyrido[3,4-b]indole
CID 70800051
9-(3-carbazol-9-ylphenyl)-3-(3-pyridin-2-ylphenyl)carbazole
CID 71277989
9-(3-carbazol-9-ylphenyl)-3-(3-pyridin-2-ylphenyl)carbazole;ethane
CID 144541414
3-carbazol-9-yl-9-(3-carbazol-9-yl-5-pyridin-2-ylphenyl)carbazole
CID 155770026
6-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-9-phenyl-3-pyridin-2-ylpyrido[3,4-b]indole
CID 88886703
9-(6-carbazol-9-yl-9,10-dipyridin-2-ylanthracen-2-yl)carbazole
CID 59221065
9-phenyl-3-[3-[3-(3-pyridin-2-ylphenyl)phenyl]phenyl]carbazole
CID 153423283
3-[3-[4,6-bis(4-pyridin-2-ylphenyl)pyrimidin-2-yl]phenyl]-9-(3-carbazol-9-ylphenyl)carbazole
CID 90209024
9-(3-carbazol-9-ylphenyl)carbazole;methane
CID 157215827
9,14-bis(3-pyridin-2-ylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 118504672
3-(9-phenylcarbazol-3-yl)-9-(4-pyridin-2-ylphenyl)carbazole
CID 118967167
3-pyridin-2-yl-9-(3,7,11-trithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl)pyrido[3,4-b]indole
CID 140711347

Frequently Asked Questions

What is the IUPAC name of 9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole?
The IUPAC name of 9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole (CID 139574913) is 9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole.
What is the SMILES notation for 9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole?
The canonical SMILES for 9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole is c1ccc(-c2cc3c4ccccc4n(-c4cccc(-n5c6ccccc6c6ccccc65)c4)c3cn2)nc1.
What is the InChIKey of 9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole?
The InChIKey is KDSMMJLNOVZGOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H22N4/c1-4-16-31-25(12-1)26-13-2-5-17-32(26)37(31)23-10-9-11-24(20-23)38-33-18-6-3-14-27(33)28-21-30(36-22-34(28)38)29-15-7-8-19-35-29/h1-22H.
What are the key properties of 9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole?
9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole has a molecular weight of 486.58 g/mol, XLogP of 8.34, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole is sourced from PubChem (CID 139574913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).