3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole

C41H27N3 — CID 118581881

IUPAC3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)nc2)cc1
InChIInChI=1S/C41H27N3/c1-3-11-28(12-4-1)31-21-24-41(42-27-31)44-38-18-10-8-16-34(38)36-26-30(20-23-40(36)44)29-19-22-39-35(25-29)33-15-7-9-17-37(33)43(39)32-13-5-2-6-14-32/h1-27H
InChIKeyOOELVUITNHRIAR-UHFFFAOYSA-N
MW561.69 g/mol
LogP10.61
Rot. Bonds4

About 3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole

3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole (PubChem CID 118581881) has the molecular formula C41H27N3 and a molecular weight of 561.69 g/mol. Its IUPAC name is 3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole.

Molecular Properties

Compound Name3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole
PubChem CID118581881
Molecular FormulaC41H27N3
Molecular Weight561.69 g/mol
Exact Mass561.22
IUPAC Name3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)nc2)cc1
InChIInChI=1S/C41H27N3/c1-3-11-28(12-4-1)31-21-24-41(42-27-31)44-38-18-10-8-16-34(38)36-26-30(20-23-40(36)44)29-19-22-39-35(25-29)33-15-7-9-17-37(33)43(39)32-13-5-2-6-14-32/h1-27H
InChIKeyOOELVUITNHRIAR-UHFFFAOYSA-N
XLogP10.61
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.69
LogP ≤ 510.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]carbazole;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 160861876
3-[9-[5-(4-dibenzofuran-2-ylphenyl)-2-pyridinyl]carbazol-3-yl]-9-phenylcarbazole
CID 90086397
9-phenyl-3-[4-[3-(4-phenylphenyl)carbazol-9-yl]phenyl]carbazole
CID 126682013
3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
CID 158377312
3-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 118268216
3-(6,9-diphenylcarbazol-3-yl)-6,9-diphenylcarbazole;3,9-diphenyl-6-(9-phenylcarbazol-3-yl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 158667860
11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-5-phenylindolo[3,2-b]carbazole
CID 118487928
3-(9-phenylcarbazol-3-yl)-9-[5-[3-(3-phenylphenyl)phenyl]pyrimidin-2-yl]carbazole
CID 90086331
3-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-6,9-diphenylcarbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]-6-(3-phenylphenyl)carbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]-6-(4-phenylphenyl)carbazole;9-phenyl-3-(4-phenylphenyl)-6-[4-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 165019259
3,9-diphenyl-6-[3-(9-phenylcarbazol-3-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 122492191
hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 163952243
3,9-diphenyl-6-[3-[3-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]phenyl]carbazole;3,9-diphenyl-6-[4-[4-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 161263241

Frequently Asked Questions

What is the IUPAC name of 3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole?
The IUPAC name of 3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole (CID 118581881) is 3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole.
What is the SMILES notation for 3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole?
The canonical SMILES for 3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole is c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)nc2)cc1.
What is the InChIKey of 3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole?
The InChIKey is OOELVUITNHRIAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H27N3/c1-3-11-28(12-4-1)31-21-24-41(42-27-31)44-38-18-10-8-16-34(38)36-26-30(20-23-40(36)44)29-19-22-39-35(25-29)33-15-7-9-17-37(33)43(39)32-13-5-2-6-14-32/h1-27H.
What are the key properties of 3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole?
3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole has a molecular weight of 561.69 g/mol, XLogP of 10.61, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole is sourced from PubChem (CID 118581881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).