9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole

C26H16BrN3 — CID 121327158

IUPAC9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole
SMILESBrc1nc2ccccc2nc1-c1ccc(-n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C26H16BrN3/c27-26-25(28-21-9-3-4-10-22(21)29-26)17-13-15-18(16-14-17)30-23-11-5-1-7-19(23)20-8-2-6-12-24(20)30/h1-16H
InChIKeySKNWNXVZLPKHCD-UHFFFAOYSA-N
MW450.34 g/mol
LogP7.16
Rot. Bonds2

About 9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole

9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole (PubChem CID 121327158) has the molecular formula C26H16BrN3 and a molecular weight of 450.34 g/mol. Its IUPAC name is 9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole
PubChem CID121327158
Molecular FormulaC26H16BrN3
Molecular Weight450.34 g/mol
Exact Mass449.05
IUPAC Name9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole
SMILESBrc1nc2ccccc2nc1-c1ccc(-n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C26H16BrN3/c27-26-25(28-21-9-3-4-10-22(21)29-26)17-13-15-18(16-14-17)30-23-11-5-1-7-19(23)20-8-2-6-12-24(20)30/h1-16H
InChIKeySKNWNXVZLPKHCD-UHFFFAOYSA-N
XLogP7.16
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.34
LogP ≤ 57.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-bis[4-(10-phenylanthracen-9-yl)phenyl]quinoxaline;9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;2-phenyl-3-[4-(10-phenylanthracen-9-yl)phenyl]quinoxaline
CID 164980722
9-phenyl-3-(4-phenylphenyl)-6-[9-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-yl]carbazole
CID 59489317
9-[4-(3-phenylphenyl)phenyl]-3-[4-[3-[4-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]phenyl]quinoxalin-2-yl]phenyl]carbazole
CID 59702563
9-[4-[4-[3-[4-(4-carbazol-9-yl-2-phenylphenyl)phenyl]quinoxalin-2-yl]phenyl]-3-phenylphenyl]carbazole
CID 59702533
3-bromo-9-[4-(2-phenylquinazolin-4-yl)phenyl]carbazole
CID 118103152
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole
CID 135323607
9-[4-[4-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041201
9-[4-[4-[3-[4-[4-carbazol-9-yl-2-(4-phenylphenyl)phenyl]phenyl]quinoxalin-2-yl]phenyl]-3-(4-phenylphenyl)phenyl]carbazole
CID 59702564
12-(4-phenylphenyl)-20-[3-(4-phenylphenyl)quinoxalin-2-yl]-12,20-diazapentacyclo[15.2.1.05,19.06,11.013,18]icosa-1,3,5(19),6,8,10,13(18),14,16-nonaene
CID 164807793
4-[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]tetrazolo[1,5-a]quinoxaline
CID 172994580
2-benzo[b]carbazol-5-yl-5-[4-(3-naphthalen-2-ylquinoxalin-2-yl)phenyl]benzo[b]carbazole
CID 146375026
3-tert-butyl-6-[4-[3-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]quinoxalin-2-yl]phenyl]-9-phenylcarbazole;9-(4-phenylphenyl)-3-[4-[3-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]quinoxalin-2-yl]phenyl]carbazole
CID 159534786

Frequently Asked Questions

What is the IUPAC name of 9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole?
The IUPAC name of 9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole (CID 121327158) is 9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole.
What is the SMILES notation for 9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole?
The canonical SMILES for 9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole is Brc1nc2ccccc2nc1-c1ccc(-n2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of 9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole?
The InChIKey is SKNWNXVZLPKHCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H16BrN3/c27-26-25(28-21-9-3-4-10-22(21)29-26)17-13-15-18(16-14-17)30-23-11-5-1-7-19(23)20-8-2-6-12-24(20)30/h1-16H.
What are the key properties of 9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole?
9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole has a molecular weight of 450.34 g/mol, XLogP of 7.16, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(3-bromoquinoxalin-2-yl)phenyl]carbazole is sourced from PubChem (CID 121327158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).