(Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole

C34H28N2 — CID 145055834

IUPAC(Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole
SMILESC/C=C\C.c1ccc(-n2c3ccccc3c3cc(-c4ccc5[nH]c6ccccc6c5c4)ccc32)cc1
InChIInChI=1S/C30H20N2.C4H8/c1-2-8-22(9-3-1)32-29-13-7-5-11-24(29)26-19-21(15-17-30(26)32)20-14-16-28-25(18-20)23-10-4-6-12-27(23)31-28;1-3-4-2/h1-19,31H;3-4H,1-2H3/b;4-3-
InChIKeyVPWQQMIBBQBACD-QGAMPUOQSA-N
MW464.61 g/mol
LogP9.67
Rot. Bonds2

About (Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole

(Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole (PubChem CID 145055834) has the molecular formula C34H28N2 and a molecular weight of 464.61 g/mol. Its IUPAC name is (Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole.

Molecular Properties

Compound Name(Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole
PubChem CID145055834
Molecular FormulaC34H28N2
Molecular Weight464.61 g/mol
Exact Mass464.23
IUPAC Name(Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole
SMILESC/C=C\C.c1ccc(-n2c3ccccc3c3cc(-c4ccc5[nH]c6ccccc6c5c4)ccc32)cc1
InChIInChI=1S/C30H20N2.C4H8/c1-2-8-22(9-3-1)32-29-13-7-5-11-24(29)26-19-21(15-17-30(26)32)20-14-16-28-25(18-20)23-10-4-6-12-27(23)31-28;1-3-4-2/h1-19,31H;3-4H,1-2H3/b;4-3-
InChIKeyVPWQQMIBBQBACD-QGAMPUOQSA-N
XLogP9.67
TPSA20.72 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.61
LogP ≤ 59.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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9-[4-(9H-carbazol-3-yl)phenyl]-3,6-bis(2-phenylphenyl)carbazole
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3-carbazol-9-yl-9-[9-[9-[9-[9-[9-(9H-carbazol-3-yl)carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazole
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10-(9H-carbazol-3-yl)-5,7-diphenylbenzo[c]carbazole
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3-dibenzothiophen-4-yl-9H-carbazole;3-dibenzothiophen-4-yl-9-phenylcarbazole
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3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
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3-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
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2-(4-bromophenyl)-3-phenylquinoxaline;3-(9H-carbazol-3-yl)-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazole
CID 159932179
3-(9H-carbazol-3-yl)-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-[9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-3-yl]-9-phenylcarbazole
CID 160628676
1-(9H-carbazol-3-yl)-9-phenylcarbazole
CID 59307184
3-(9H-carbazol-3-yl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-5-yl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-5-yl]-3-[9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-5-yl]carbazol-3-yl]carbazole
CID 160627563

Frequently Asked Questions

What is the IUPAC name of (Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole?
The IUPAC name of (Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole (CID 145055834) is (Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole.
What is the SMILES notation for (Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole?
The canonical SMILES for (Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole is C/C=C\C.c1ccc(-n2c3ccccc3c3cc(-c4ccc5[nH]c6ccccc6c5c4)ccc32)cc1.
What is the InChIKey of (Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole?
The InChIKey is VPWQQMIBBQBACD-QGAMPUOQSA-N. The full InChI is InChI=1S/C30H20N2.C4H8/c1-2-8-22(9-3-1)32-29-13-7-5-11-24(29)26-19-21(15-17-30(26)32)20-14-16-28-25(18-20)23-10-4-6-12-27(23)31-28;1-3-4-2/h1-19,31H;3-4H,1-2H3/b;4-3-.
What are the key properties of (Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole?
(Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole has a molecular weight of 464.61 g/mol, XLogP of 9.67, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole is sourced from PubChem (CID 145055834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).