6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene

C50H36N2O — CID 142356536

IUPAC6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene
SMILESC=C.Oc1ccc2c(c1)c1cc(-c3ccc4c(c3)c3ccccc3n4-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)ccc1n2-c1ccccc1
InChIInChI=1S/C48H32N2O.C2H4/c51-40-22-25-48-44(31-40)43-30-35(21-24-47(43)49(48)38-16-8-3-9-17-38)34-20-23-46-42(29-34)41-18-10-11-19-45(41)50(46)39-27-36(32-12-4-1-5-13-32)26-37(28-39)33-14-6-2-7-15-33;1-2/h1-31,51H;1-2H2
InChIKeyUZCWKGIDILZJGS-UHFFFAOYSA-N
MW680.85 g/mol
LogP13.39
Rot. Bonds5

About 6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene

6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene (PubChem CID 142356536) has the molecular formula C50H36N2O and a molecular weight of 680.85 g/mol. Its IUPAC name is 6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene.

Molecular Properties

Compound Name6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene
PubChem CID142356536
Molecular FormulaC50H36N2O
Molecular Weight680.85 g/mol
Exact Mass680.28
IUPAC Name6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene
SMILESC=C.Oc1ccc2c(c1)c1cc(-c3ccc4c(c3)c3ccccc3n4-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)ccc1n2-c1ccccc1
InChIInChI=1S/C48H32N2O.C2H4/c51-40-22-25-48-44(31-40)43-30-35(21-24-47(43)49(48)38-16-8-3-9-17-38)34-20-23-46-42(29-34)41-18-10-11-19-45(41)50(46)39-27-36(32-12-4-1-5-13-32)26-37(28-39)33-14-6-2-7-15-33;1-2/h1-31,51H;1-2H2
InChIKeyUZCWKGIDILZJGS-UHFFFAOYSA-N
XLogP13.39
TPSA30.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500680.85
LogP ≤ 513.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 161445204
3,9-diphenyl-6-[3-(9-phenylcarbazol-3-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 122492191
3-[3-[9-(3,5-diphenylphenyl)carbazol-3-yl]phenyl]-9-phenylcarbazole;9-(3-phenylphenyl)-3-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 158535060
3-phenyl-9-[3-(9-phenylcarbazol-2-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 122492182
3,6-diphenyl-9-[3-phenyl-5-(9-phenylcarbazol-2-yl)phenyl]carbazole
CID 118084408
3-[9-[3-(3-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-phenyl-5-(3-phenylphenyl)phenyl]carbazole
CID 157108405
9-[3-(3,5-diphenylphenyl)phenyl]-3-[9-[3-[3-[3-[9-[3-(3,5-diphenylphenyl)phenyl]-6-phenylcarbazol-3-yl]carbazol-9-yl]phenyl]phenyl]carbazol-3-yl]-6-phenylcarbazole
CID 129265445
9-[3-[3-[3-[3-[3-[3-(3-phenylphenyl)phenyl]-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]-3-[9-[3-[3-[3-[3-[3-[3-(3-phenylphenyl)phenyl]-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]carbazole
CID 167244726
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
9-[4-(3,5-diphenylphenyl)phenyl]-3-phenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 118231210
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
2-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(3,5-diphenylphenyl)carbazol-2-yl]-9-(3-phenylphenyl)carbazole
CID 158200514

Frequently Asked Questions

What is the IUPAC name of 6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene?
The IUPAC name of 6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene (CID 142356536) is 6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene.
What is the SMILES notation for 6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene?
The canonical SMILES for 6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene is C=C.Oc1ccc2c(c1)c1cc(-c3ccc4c(c3)c3ccccc3n4-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)ccc1n2-c1ccccc1.
What is the InChIKey of 6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene?
The InChIKey is UZCWKGIDILZJGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32N2O.C2H4/c51-40-22-25-48-44(31-40)43-30-35(21-24-47(43)49(48)38-16-8-3-9-17-38)34-20-23-46-42(29-34)41-18-10-11-19-45(41)50(46)39-27-36(32-12-4-1-5-13-32)26-37(28-39)33-14-6-2-7-15-33;1-2/h1-31,51H;1-2H2.
What are the key properties of 6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene?
6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene has a molecular weight of 680.85 g/mol, XLogP of 13.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazol-3-ol;ethene is sourced from PubChem (CID 142356536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).