9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole

C36H26N2 — CID 118228720

IUPAC9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole
SMILESC1=CC(c2cccc3c4ccccc4n(-c4ccccc4)c23)Cc2c1n(-c1ccccc1)c1ccccc21
InChIInChI=1S/C36H26N2/c1-3-12-26(13-4-1)37-33-20-9-8-17-30(33)32-24-25(22-23-35(32)37)28-18-11-19-31-29-16-7-10-21-34(29)38(36(28)31)27-14-5-2-6-15-27/h1-23,25H,24H2
InChIKeyVSYPHNCOFLKUKN-UHFFFAOYSA-N
MW486.62 g/mol
LogP9.08
Rot. Bonds3

About 9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole

9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole (PubChem CID 118228720) has the molecular formula C36H26N2 and a molecular weight of 486.62 g/mol. Its IUPAC name is 9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole.

Molecular Properties

Compound Name9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole
PubChem CID118228720
Molecular FormulaC36H26N2
Molecular Weight486.62 g/mol
Exact Mass486.21
IUPAC Name9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole
SMILESC1=CC(c2cccc3c4ccccc4n(-c4ccccc4)c23)Cc2c1n(-c1ccccc1)c1ccccc21
InChIInChI=1S/C36H26N2/c1-3-12-26(13-4-1)37-33-20-9-8-17-30(33)32-24-25(22-23-35(32)37)28-18-11-19-31-29-16-7-10-21-34(29)38(36(28)31)27-14-5-2-6-15-27/h1-23,25H,24H2
InChIKeyVSYPHNCOFLKUKN-UHFFFAOYSA-N
XLogP9.08
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.62
LogP ≤ 59.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 23860
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CID 621047
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CID 3090393
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CID 33699
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Frequently Asked Questions

What is the IUPAC name of 9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole?
The IUPAC name of 9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole (CID 118228720) is 9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole.
What is the SMILES notation for 9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole?
The canonical SMILES for 9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole is C1=CC(c2cccc3c4ccccc4n(-c4ccccc4)c23)Cc2c1n(-c1ccccc1)c1ccccc21.
What is the InChIKey of 9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole?
The InChIKey is VSYPHNCOFLKUKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26N2/c1-3-12-26(13-4-1)37-33-20-9-8-17-30(33)32-24-25(22-23-35(32)37)28-18-11-19-31-29-16-7-10-21-34(29)38(36(28)31)27-14-5-2-6-15-27/h1-23,25H,24H2.
What are the key properties of 9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole?
9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole has a molecular weight of 486.62 g/mol, XLogP of 9.08, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole is sourced from PubChem (CID 118228720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).