4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole

C101H65Br3N10 — CID 158417325

IUPAC4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole
SMILESBrc1cccc2c1c1ccccc1n2-c1ccc(-c2cc(-c3ccccn3)cc(-c3ccccn3)c2)cc1.Brc1cccc2c1c1ccccc1n2-c1ccc(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)cc1.Brc1cccc2c1c1ccccc1n2-c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1
InChIInChI=1S/2C34H22BrN3.C33H21BrN4/c35-28-15-9-17-32-33(28)27-14-7-8-16-31(27)38(32)26-20-18-25(19-21-26)34-36-29(23-10-3-1-4-11-23)22-30(37-34)24-12-5-2-6-13-24;35-29-9-7-13-33-34(29)28-8-1-2-12-32(28)38(33)27-16-14-23(15-17-27)24-20-25(30-10-3-5-18-36-30)22-26(21-24)31-11-4-6-19-37-31;34-27-15-9-17-29-30(27)26-14-7-8-16-28(26)38(29)25-20-18-24(19-21-25)33-36-31(22-10-3-1-4-11-22)35-32(37-33)23-12-5-2-6-13-23/h2*1-22H;1-21H
InChIKeyHABFCIHTIUHPIJ-UHFFFAOYSA-N
MW1658.41 g/mol
LogP27.41
Rot. Bonds12

About 4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole

4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole (PubChem CID 158417325) has the molecular formula C101H65Br3N10 and a molecular weight of 1658.41 g/mol. Its IUPAC name is 4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole.

Molecular Properties

Compound Name4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole
PubChem CID158417325
Molecular FormulaC101H65Br3N10
Molecular Weight1658.41 g/mol
Exact Mass1654.29
IUPAC Name4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole
SMILESBrc1cccc2c1c1ccccc1n2-c1ccc(-c2cc(-c3ccccn3)cc(-c3ccccn3)c2)cc1.Brc1cccc2c1c1ccccc1n2-c1ccc(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)cc1.Brc1cccc2c1c1ccccc1n2-c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1
InChIInChI=1S/2C34H22BrN3.C33H21BrN4/c35-28-15-9-17-32-33(28)27-14-7-8-16-31(27)38(32)26-20-18-25(19-21-26)34-36-29(23-10-3-1-4-11-23)22-30(37-34)24-12-5-2-6-13-24;35-29-9-7-13-33-34(29)28-8-1-2-12-32(28)38(33)27-16-14-23(15-17-27)24-20-25(30-10-3-5-18-36-30)22-26(21-24)31-11-4-6-19-37-31;34-27-15-9-17-29-30(27)26-14-7-8-16-28(26)38(29)25-20-18-24(19-21-25)33-36-31(22-10-3-1-4-11-22)35-32(37-33)23-12-5-2-6-13-23/h2*1-22H;1-21H
InChIKeyHABFCIHTIUHPIJ-UHFFFAOYSA-N
XLogP27.41
TPSA105.02 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds12
Heavy Atoms114
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001658.41
LogP ≤ 527.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole with MolForge

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Related Compounds

4-bromo-9-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazole;4-bromo-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazole
CID 157094301
4-bromo-9-(2,6-diphenyl-4-pyridinyl)carbazole;4-bromo-9-(4,6-diphenyl-2-pyridinyl)carbazole;4-bromo-9-(3,5-dipyridin-2-ylphenyl)carbazole;4-bromo-9-(2,6-dipyridin-2-yl-4-pyridinyl)carbazole
CID 159947766
9-[4-[2-[4-[4-[4-(4-carbazol-9-ylphenyl)-6-(4-pyridin-2-ylphenyl)pyrimidin-2-yl]phenyl]phenyl]-6-(4-pyridin-2-ylphenyl)pyrimidin-4-yl]phenyl]carbazole
CID 88557862
9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-phenyl-14-(3-phenyl-5-pyridin-2-ylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-phenyl-14-(3-pyridin-2-ylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 161276127
9-[4-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazole;9-[4-(2,6-dipyridin-2-ylpyrimidin-4-yl)phenyl]carbazole;9-[4-(4,6-dipyridin-2-ylpyrimidin-2-yl)phenyl]carbazole;9-[4-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 157415442
9-[4-[4-[3-(2,6-diphenylpyrimidin-4-yl)-5-(4-phenylphenyl)phenyl]phenyl]phenyl]carbazole
CID 58943231
3-(9-phenylcarbazol-3-yl)-9-[4-[6-(4-phenylphenyl)-2-(4-pyridin-2-ylphenyl)pyrimidin-4-yl]phenyl]carbazole
CID 176826323
1-bromo-9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;1-bromo-9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;1-bromo-9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazole;1-bromo-9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazole
CID 159934000
9-[4-[4-[4-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 163590019
9-[4-[4-[2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-phenyl-4-pyridinyl]phenyl]phenyl]carbazole;9-[4-[4-[6-[4-(4-carbazol-9-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]phenyl]carbazole;9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole
CID 158785186
1-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole
CID 118586942
3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole
CID 158224384

Frequently Asked Questions

What is the IUPAC name of 4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole?
The IUPAC name of 4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole (CID 158417325) is 4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole.
What is the SMILES notation for 4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole?
The canonical SMILES for 4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole is Brc1cccc2c1c1ccccc1n2-c1ccc(-c2cc(-c3ccccn3)cc(-c3ccccn3)c2)cc1.Brc1cccc2c1c1ccccc1n2-c1ccc(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)cc1.Brc1cccc2c1c1ccccc1n2-c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1.
What is the InChIKey of 4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole?
The InChIKey is HABFCIHTIUHPIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C34H22BrN3.C33H21BrN4/c35-28-15-9-17-32-33(28)27-14-7-8-16-31(27)38(32)26-20-18-25(19-21-26)34-36-29(23-10-3-1-4-11-23)22-30(37-34)24-12-5-2-6-13-24;35-29-9-7-13-33-34(29)28-8-1-2-12-32(28)38(33)27-16-14-23(15-17-27)24-20-25(30-10-3-5-18-36-30)22-26(21-24)31-11-4-6-19-37-31;34-27-15-9-17-29-30(27)26-14-7-8-16-28(26)38(29)25-20-18-24(19-21-25)33-36-31(22-10-3-1-4-11-22)35-32(37-33)23-12-5-2-6-13-23/h2*1-22H;1-21H.
What are the key properties of 4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole?
4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole has a molecular weight of 1658.41 g/mol, XLogP of 27.41, 12 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;4-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;4-bromo-9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]carbazole is sourced from PubChem (CID 158417325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).