9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole

C37H25F2N — CID 59629480

IUPAC9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole
SMILESCc1c(F)cc(-c2ccc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1F
InChIInChI=1S/C37H25F2N/c1-24-34(38)22-30(23-35(24)39)29-16-14-26(15-17-29)25-10-12-27(13-11-25)28-18-20-31(21-19-28)40-36-8-4-2-6-32(36)33-7-3-5-9-37(33)40/h2-23H,1H3
InChIKeyWMJAGSSXWSUKQR-UHFFFAOYSA-N
MW521.61 g/mol
LogP10.37
Rot. Bonds4

About 9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole

9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole (PubChem CID 59629480) has the molecular formula C37H25F2N and a molecular weight of 521.61 g/mol. Its IUPAC name is 9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole.

Molecular Properties

Compound Name9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole
PubChem CID59629480
Molecular FormulaC37H25F2N
Molecular Weight521.61 g/mol
Exact Mass521.20
IUPAC Name9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole
SMILESCc1c(F)cc(-c2ccc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1F
InChIInChI=1S/C37H25F2N/c1-24-34(38)22-30(23-35(24)39)29-16-14-26(15-17-29)25-10-12-27(13-11-25)28-18-20-31(21-19-28)40-36-8-4-2-6-32(36)33-7-3-5-9-37(33)40/h2-23H,1H3
InChIKeyWMJAGSSXWSUKQR-UHFFFAOYSA-N
XLogP10.37
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500521.61
LogP ≤ 510.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;ethane
CID 143126318
9-[4-[4-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041201
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole
CID 135323607
3-fluoro-9-[4-[4-(3-fluorocarbazol-9-yl)phenyl]phenyl]carbazole
CID 23534181
9-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]carbazole
CID 58939501
9-[4-(3,5-diphenylphenyl)phenyl]-3-phenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 118231210
3-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 90085403
9-[4-[3-(3,5-diphenylphenyl)phenyl]phenyl]carbazole
CID 118595106
3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
CID 20685483
5-phenyl-11-[4-(4-phenylphenyl)phenyl]indolo[3,2-b]carbazole
CID 142356573
9-[4-[3-[3-(4-carbazol-9-ylphenyl)-5-phenylphenyl]phenyl]phenyl]carbazole;9-[4-[3-[3-(4-carbazol-9-ylphenyl)-5-phenylphenyl]-5-phenylphenyl]phenyl]carbazole
CID 159046230
3-carbazol-9-yl-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 149208011

Frequently Asked Questions

What is the IUPAC name of 9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole?
The IUPAC name of 9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole (CID 59629480) is 9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole.
What is the SMILES notation for 9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole?
The canonical SMILES for 9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole is Cc1c(F)cc(-c2ccc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1F.
What is the InChIKey of 9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole?
The InChIKey is WMJAGSSXWSUKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H25F2N/c1-24-34(38)22-30(23-35(24)39)29-16-14-26(15-17-29)25-10-12-27(13-11-25)28-18-20-31(21-19-28)40-36-8-4-2-6-32(36)33-7-3-5-9-37(33)40/h2-23H,1H3.
What are the key properties of 9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole?
9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole has a molecular weight of 521.61 g/mol, XLogP of 10.37, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[4-[4-(3,5-difluoro-4-methylphenyl)phenyl]phenyl]phenyl]carbazole is sourced from PubChem (CID 59629480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).