7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole

C36H23N3 — CID 163967651

IUPAC7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole
SMILESc1ccc(-c2ccc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5ccc43)cc2)cc1
InChIInChI=1S/C36H23N3/c1-2-10-24(11-3-1)25-18-20-27(21-19-25)35-36(38-31-16-8-7-15-30(31)37-35)39-32-17-9-6-14-29(32)34-28-13-5-4-12-26(28)22-23-33(34)39/h1-23H
InChIKeySNFIXKXBICQGGV-UHFFFAOYSA-N
MW497.60 g/mol
LogP9.21
Rot. Bonds3

About 7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole

7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole (PubChem CID 163967651) has the molecular formula C36H23N3 and a molecular weight of 497.60 g/mol. Its IUPAC name is 7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole.

Molecular Properties

Compound Name7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole
PubChem CID163967651
Molecular FormulaC36H23N3
Molecular Weight497.60 g/mol
Exact Mass497.19
IUPAC Name7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole
SMILESc1ccc(-c2ccc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5ccc43)cc2)cc1
InChIInChI=1S/C36H23N3/c1-2-10-24(11-3-1)25-18-20-27(21-19-25)35-36(38-31-16-8-7-15-30(31)37-35)39-32-17-9-6-14-29(32)34-28-13-5-4-12-26(28)22-23-33(34)39/h1-23H
InChIKeySNFIXKXBICQGGV-UHFFFAOYSA-N
XLogP9.21
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500497.60
LogP ≤ 59.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-benzo[c]carbazol-7-yl-5-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole
CID 146375178
10-benzo[c]carbazol-7-yl-7-(3-phenanthren-3-ylquinoxalin-2-yl)benzo[c]carbazole
CID 162481423
9-naphthalen-1-yl-12-[3-(4-phenylphenyl)quinoxalin-2-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 129149761
10-chloro-7-[3-(4-naphthalen-2-ylphenyl)quinoxalin-2-yl]benzo[c]carbazole
CID 162481159
9,12-diphenyl-16-(3-phenylquinoxalin-2-yl)-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene;12-phenyl-16-[3-(4-phenylphenyl)quinoxalin-2-yl]-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene;12-phenyl-16-[4-(3-phenylquinoxalin-2-yl)phenyl]-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 163789996
12-(3-phenylquinoxalin-2-yl)-1,12-diazaoctacyclo[15.13.2.02,11.04,9.013,32.020,31.021,30.022,27]dotriaconta-2,4,6,8,10,13,15,17(32),18,20(31),21(30),22,24,26,28-pentadecaene
CID 170381299
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
7-(3-methylquinoxalin-2-yl)benzo[c]carbazole
CID 130265958
14-(3-phenylquinoxalin-2-yl)-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 139422459
12-(4-phenylphenyl)-16-(4-phenylquinazolin-2-yl)-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene;12-(4-phenylphenyl)-16-(3-phenylquinoxalin-2-yl)-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene;12-phenyl-16-[3-(3-phenylphenyl)quinoxalin-2-yl]-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene;12-phenyl-16-(4-phenylquinazolin-2-yl)-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 160926050
7-[9-(3-phenylphenyl)carbazol-4-yl]-11-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[a]carbazole
CID 155114239
5-(3-phenanthren-2-ylquinoxalin-2-yl)-2-phenylbenzo[b]carbazole
CID 146539824

Frequently Asked Questions

What is the IUPAC name of 7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole?
The IUPAC name of 7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole (CID 163967651) is 7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole.
What is the SMILES notation for 7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole?
The canonical SMILES for 7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole is c1ccc(-c2ccc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5ccc43)cc2)cc1.
What is the InChIKey of 7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole?
The InChIKey is SNFIXKXBICQGGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H23N3/c1-2-10-24(11-3-1)25-18-20-27(21-19-25)35-36(38-31-16-8-7-15-30(31)37-35)39-32-17-9-6-14-29(32)34-28-13-5-4-12-26(28)22-23-33(34)39/h1-23H.
What are the key properties of 7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole?
7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole has a molecular weight of 497.60 g/mol, XLogP of 9.21, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[3-(4-phenylphenyl)quinoxalin-2-yl]benzo[c]carbazole is sourced from PubChem (CID 163967651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).