3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole

C28H17F2N3 — CID 140902302

IUPAC3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole
SMILESFc1cc(-c2ccccn2)c2[nH]c3c(-c4cccc(-c5ccccc5)n4)cc(F)cc3c2c1
InChIInChI=1S/C28H17F2N3/c29-18-13-20-21-14-19(30)16-23(26-11-6-10-24(32-26)17-7-2-1-3-8-17)28(21)33-27(20)22(15-18)25-9-4-5-12-31-25/h1-16,33H
InChIKeyOKLYENWYPBLGFZ-UHFFFAOYSA-N
MW433.46 g/mol
LogP7.39
Rot. Bonds3

About 3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole

3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole (PubChem CID 140902302) has the molecular formula C28H17F2N3 and a molecular weight of 433.46 g/mol. Its IUPAC name is 3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole.

Molecular Properties

Compound Name3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole
PubChem CID140902302
Molecular FormulaC28H17F2N3
Molecular Weight433.46 g/mol
Exact Mass433.14
IUPAC Name3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole
SMILESFc1cc(-c2ccccn2)c2[nH]c3c(-c4cccc(-c5ccccc5)n4)cc(F)cc3c2c1
InChIInChI=1S/C28H17F2N3/c29-18-13-20-21-14-19(30)16-23(26-11-6-10-24(32-26)17-7-2-1-3-8-17)28(21)33-27(20)22(15-18)25-9-4-5-12-31-25/h1-16,33H
InChIKeyOKLYENWYPBLGFZ-UHFFFAOYSA-N
XLogP7.39
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.46
LogP ≤ 57.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,6-ditert-butyl-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole
CID 140902252
3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole
CID 140902282
1-pyridin-2-yl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole
CID 164788747
1-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]-8-pyridin-2-yl-9H-carbazole
CID 140902230
3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole
CID 102596077
3,6-ditert-butyl-1-(6-phenyl-2-pyridinyl)-8-(6-phenylpyrimidin-4-yl)-9H-carbazole
CID 140902431
iridium(3+);2-phenyl-6-pyridin-2-ylpyridine
CID 159332179
2-phenyl-6-pyridin-2-ylpyridine;platinum(2+)
CID 161405876
1-isoquinolin-3-yl-8-(6-phenyl-2-pyridinyl)-9H-carbazole
CID 140902398
1-pyridin-2-yl-3,6-dipyridin-3-yl-8-(3-pyridin-2-ylphenyl)-9H-carbazole
CID 140902369
1-(6-phenyl-2-pyridinyl)-9H-carbazole
CID 171438775
3,6-ditert-butyl-1-[6-(2H-isoindol-1-yl)-2-pyridinyl]-8-pyridin-2-yl-9H-carbazole
CID 140902473

Frequently Asked Questions

What is the IUPAC name of 3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole?
The IUPAC name of 3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole (CID 140902302) is 3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole.
What is the SMILES notation for 3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole?
The canonical SMILES for 3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole is Fc1cc(-c2ccccn2)c2[nH]c3c(-c4cccc(-c5ccccc5)n4)cc(F)cc3c2c1.
What is the InChIKey of 3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole?
The InChIKey is OKLYENWYPBLGFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H17F2N3/c29-18-13-20-21-14-19(30)16-23(26-11-6-10-24(32-26)17-7-2-1-3-8-17)28(21)33-27(20)22(15-18)25-9-4-5-12-31-25/h1-16,33H.
What are the key properties of 3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole?
3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole has a molecular weight of 433.46 g/mol, XLogP of 7.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole is sourced from PubChem (CID 140902302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).