3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole

C38H24BrN — CID 118087817

IUPAC3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole
SMILESBrc1ccc2c(c1)c1ccccc1n2-c1cc(-c2cccc3ccccc23)cc(-c2cccc3ccccc23)c1
InChIInChI=1S/C38H24BrN/c39-29-19-20-38-36(24-29)35-15-5-6-18-37(35)40(38)30-22-27(33-16-7-11-25-9-1-3-13-31(25)33)21-28(23-30)34-17-8-12-26-10-2-4-14-32(26)34/h1-24H
InChIKeyIKGALKAZMJNCMT-UHFFFAOYSA-N
MW574.52 g/mol
LogP11.19
Rot. Bonds3

About 3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole

3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole (PubChem CID 118087817) has the molecular formula C38H24BrN and a molecular weight of 574.52 g/mol. Its IUPAC name is 3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole.

Molecular Properties

Compound Name3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole
PubChem CID118087817
Molecular FormulaC38H24BrN
Molecular Weight574.52 g/mol
Exact Mass573.11
IUPAC Name3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole
SMILESBrc1ccc2c(c1)c1ccccc1n2-c1cc(-c2cccc3ccccc23)cc(-c2cccc3ccccc23)c1
InChIInChI=1S/C38H24BrN/c39-29-19-20-38-36(24-29)35-15-5-6-18-37(35)40(38)30-22-27(33-16-7-11-25-9-1-3-13-31(25)33)21-28(23-30)34-17-8-12-26-10-2-4-14-32(26)34/h1-24H
InChIKeyIKGALKAZMJNCMT-UHFFFAOYSA-N
XLogP11.19
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.52
LogP ≤ 511.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-bromo-9-[3-naphthalen-1-yl-5-(2-phenylphenyl)phenyl]carbazole
CID 118087614
3-bromo-9-[3-(2-phenylphenyl)-5-(4-phenylphenyl)phenyl]carbazole
CID 118087762
2-bromo-9-(4-naphthalen-1-ylphenyl)carbazole
CID 130250089
3-dibenzofuran-4-yl-9-(3,5-dinaphthalen-1-ylphenyl)carbazole
CID 142356757
3-[9-(3-naphthalen-1-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(3-phenylphenyl)phenyl]carbazole
CID 159858070
3,6-dibromo-9-fluoranthen-2-ylcarbazole
CID 175609532
3-bromo-9-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 141339082
3-naphthalen-1-yl-9-phenyl-6-[2-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 126764169
3-[4-[9-(3-naphthalen-1-yl-5-phenylphenyl)carbazol-3-yl]phenyl]-N,N-diphenylaniline
CID 118087606
3-[3-(4-bromophenyl)phenyl]-9-(3,5-diphenylphenyl)carbazole
CID 90215090
3-bromo-9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole
CID 90177181
9-(3-carbazol-9-yl-5-naphthalen-1-ylphenyl)carbazole;9-(3-carbazol-9-yl-5-naphthalen-2-ylphenyl)carbazole;9-(3-carbazol-9-yl-5-phenanthren-9-ylphenyl)carbazole
CID 160733324

Frequently Asked Questions

What is the IUPAC name of 3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole?
The IUPAC name of 3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole (CID 118087817) is 3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole.
What is the SMILES notation for 3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole?
The canonical SMILES for 3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole is Brc1ccc2c(c1)c1ccccc1n2-c1cc(-c2cccc3ccccc23)cc(-c2cccc3ccccc23)c1.
What is the InChIKey of 3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole?
The InChIKey is IKGALKAZMJNCMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H24BrN/c39-29-19-20-38-36(24-29)35-15-5-6-18-37(35)40(38)30-22-27(33-16-7-11-25-9-1-3-13-31(25)33)21-28(23-30)34-17-8-12-26-10-2-4-14-32(26)34/h1-24H.
What are the key properties of 3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole?
3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole has a molecular weight of 574.52 g/mol, XLogP of 11.19, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-9-(3,5-dinaphthalen-1-ylphenyl)carbazole is sourced from PubChem (CID 118087817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).