2-bromo-3-carbazol-9-yl-9-phenylcarbazole

C30H19BrN2 — CID 134598351

IUPAC2-bromo-3-carbazol-9-yl-9-phenylcarbazole
SMILESBrc1cc2c(cc1-n1c3ccccc3c3ccccc31)c1ccccc1n2-c1ccccc1
InChIInChI=1S/C30H19BrN2/c31-25-19-29-24(23-14-6-7-15-26(23)32(29)20-10-2-1-3-11-20)18-30(25)33-27-16-8-4-12-21(27)22-13-5-9-17-28(22)33/h1-19H
InChIKeyLZDNTBTWYVFIPR-UHFFFAOYSA-N
MW487.40 g/mol
LogP8.64
Rot. Bonds2

About 2-bromo-3-carbazol-9-yl-9-phenylcarbazole

2-bromo-3-carbazol-9-yl-9-phenylcarbazole (PubChem CID 134598351) has the molecular formula C30H19BrN2 and a molecular weight of 487.40 g/mol. Its IUPAC name is 2-bromo-3-carbazol-9-yl-9-phenylcarbazole.

Molecular Properties

Compound Name2-bromo-3-carbazol-9-yl-9-phenylcarbazole
PubChem CID134598351
Molecular FormulaC30H19BrN2
Molecular Weight487.40 g/mol
Exact Mass486.07
IUPAC Name2-bromo-3-carbazol-9-yl-9-phenylcarbazole
SMILESBrc1cc2c(cc1-n1c3ccccc3c3ccccc31)c1ccccc1n2-c1ccccc1
InChIInChI=1S/C30H19BrN2/c31-25-19-29-24(23-14-6-7-15-26(23)32(29)20-10-2-1-3-11-20)18-30(25)33-27-16-8-4-12-21(27)22-13-5-9-17-28(22)33/h1-19H
InChIKeyLZDNTBTWYVFIPR-UHFFFAOYSA-N
XLogP8.64
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.40
LogP ≤ 58.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

12,24-dibromo-9,21-diphenyl-9,21-diazahexacyclo[11.11.0.02,10.03,8.014,22.015,20]tetracosa-1,3,5,7,10,12,14(22),15,17,19,23-undecaene
CID 163799671
9-(3-bromonaphthalen-2-yl)carbazole
CID 166009716
14,24-diphenyl-14,24-diazahexacyclo[13.11.0.02,7.08,13.017,25.018,23]hexacosa-1(15),2,4,6,8,10,12,16,18,20,22,25-dodecaene
CID 118216147
3-carbazol-9-yl-6-(3-carbazol-9-ylcarbazol-9-yl)-9-phenylcarbazole
CID 146337769
2-carbazol-9-yl-9-phenylcarbazole
CID 118335086
2-carbazol-9-yl-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
CID 176837359
2-methyl-9-phenylcarbazole
CID 59552741
2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole
CID 118504684
5-phenyl-11-[4-(4-phenylphenyl)phenyl]indolo[3,2-b]carbazole
CID 142356573
2-(3-carbazol-9-ylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazole
CID 121274440
2-bromo-9-(9-phenylcarbazol-2-yl)carbazole
CID 167514320
5-phenyl-11-[2-(4-phenylphenyl)phenyl]indolo[3,2-b]carbazole
CID 164847594

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3-carbazol-9-yl-9-phenylcarbazole?
The IUPAC name of 2-bromo-3-carbazol-9-yl-9-phenylcarbazole (CID 134598351) is 2-bromo-3-carbazol-9-yl-9-phenylcarbazole.
What is the SMILES notation for 2-bromo-3-carbazol-9-yl-9-phenylcarbazole?
The canonical SMILES for 2-bromo-3-carbazol-9-yl-9-phenylcarbazole is Brc1cc2c(cc1-n1c3ccccc3c3ccccc31)c1ccccc1n2-c1ccccc1.
What is the InChIKey of 2-bromo-3-carbazol-9-yl-9-phenylcarbazole?
The InChIKey is LZDNTBTWYVFIPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19BrN2/c31-25-19-29-24(23-14-6-7-15-26(23)32(29)20-10-2-1-3-11-20)18-30(25)33-27-16-8-4-12-21(27)22-13-5-9-17-28(22)33/h1-19H.
What are the key properties of 2-bromo-3-carbazol-9-yl-9-phenylcarbazole?
2-bromo-3-carbazol-9-yl-9-phenylcarbazole has a molecular weight of 487.40 g/mol, XLogP of 8.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-3-carbazol-9-yl-9-phenylcarbazole is sourced from PubChem (CID 134598351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).