9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole

C33H23N3 — CID 175102153

IUPAC9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2cccc(-n3ccnc3)c2)cc1
InChIInChI=1S/C33H23N3/c1-3-8-24(9-4-1)26-14-16-32-30(20-26)31-21-27(25-10-5-2-6-11-25)15-17-33(31)36(32)29-13-7-12-28(22-29)35-19-18-34-23-35/h1-23H
InChIKeyGFUJOIFGAQPSIB-UHFFFAOYSA-N
MW461.57 g/mol
LogP8.30
Rot. Bonds4

About 9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole

9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole (PubChem CID 175102153) has the molecular formula C33H23N3 and a molecular weight of 461.57 g/mol. Its IUPAC name is 9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole.

Molecular Properties

Compound Name9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole
PubChem CID175102153
Molecular FormulaC33H23N3
Molecular Weight461.57 g/mol
Exact Mass461.19
IUPAC Name9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2cccc(-n3ccnc3)c2)cc1
InChIInChI=1S/C33H23N3/c1-3-8-24(9-4-1)26-14-16-32-30(20-26)31-21-27(25-10-5-2-6-11-25)15-17-33(31)36(32)29-13-7-12-28(22-29)35-19-18-34-23-35/h1-23H
InChIKeyGFUJOIFGAQPSIB-UHFFFAOYSA-N
XLogP8.30
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500461.57
LogP ≤ 58.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3,6-ditert-butyl-9-(3-imidazol-1-ylphenyl)carbazole
CID 175094962
9-[3-(3,5-diphenylphenyl)phenyl]-3,6-diphenylcarbazole
CID 166509860
9-phenyl-3-(3-phenylphenyl)-6-[4-[9-phenyl-6-(3-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 129054646
5-(3-carbazol-9-ylphenyl)-8-phenylpyrido[4,3-b]indole
CID 170060228
3-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-6,9-diphenylcarbazole;9-phenyl-3-(4-phenylphenyl)-6-[4-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 158399670
3,6-bis(3,6-diphenylcarbazol-9-yl)-9-phenylcarbazole
CID 170001752
3,9-diphenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 118449494
9-(3-phenylphenyl)-6-[9-(3-phenylphenyl)carbazol-3-yl]pyrido[3,4-b]indole
CID 90336623
9-(3-phenylphenyl)-6-[4-[9-(3-phenylphenyl)carbazol-3-yl]phenyl]pyrido[3,4-b]indole
CID 146187368
9-[3-[3,6-bis(3-carbazol-9-ylphenyl)carbazol-9-yl]phenyl]-3,6-bis(3-carbazol-9-ylphenyl)carbazole
CID 153162679
3,6-diphenyl-9-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 153302022
3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161279377

Frequently Asked Questions

What is the IUPAC name of 9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole?
The IUPAC name of 9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole (CID 175102153) is 9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole.
What is the SMILES notation for 9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole?
The canonical SMILES for 9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole is c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2cccc(-n3ccnc3)c2)cc1.
What is the InChIKey of 9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole?
The InChIKey is GFUJOIFGAQPSIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H23N3/c1-3-8-24(9-4-1)26-14-16-32-30(20-26)31-21-27(25-10-5-2-6-11-25)15-17-33(31)36(32)29-13-7-12-28(22-29)35-19-18-34-23-35/h1-23H.
What are the key properties of 9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole?
9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole has a molecular weight of 461.57 g/mol, XLogP of 8.30, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-imidazol-1-ylphenyl)-3,6-diphenylcarbazole is sourced from PubChem (CID 175102153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).