3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole

C39H29N — CID 146661084

IUPAC3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole
SMILESC(=C(/Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1)c1ccccc1)\c1ccccc1
InChIInChI=1S/C39H29N/c1-4-12-29(13-5-1)26-34(31-14-6-2-7-15-31)27-30-20-22-32(23-21-30)33-24-25-39-37(28-33)36-18-10-11-19-38(36)40(39)35-16-8-3-9-17-35/h1-26,28H,27H2/b34-26-
InChIKeyHNQZZDAQZXJPEH-CLIDGEQKSA-N
MW511.67 g/mol
LogP10.23
Rot. Bonds6

About 3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole

3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole (PubChem CID 146661084) has the molecular formula C39H29N and a molecular weight of 511.67 g/mol. Its IUPAC name is 3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole
PubChem CID146661084
Molecular FormulaC39H29N
Molecular Weight511.67 g/mol
Exact Mass511.23
IUPAC Name3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole
SMILESC(=C(/Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1)c1ccccc1)\c1ccccc1
InChIInChI=1S/C39H29N/c1-4-12-29(13-5-1)26-34(31-14-6-2-7-15-31)27-30-20-22-32(23-21-30)33-24-25-39-37(28-33)36-18-10-11-19-38(36)40(39)35-16-8-3-9-17-35/h1-26,28H,27H2/b34-26-
InChIKeyHNQZZDAQZXJPEH-CLIDGEQKSA-N
XLogP10.23
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500511.67
LogP ≤ 510.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

9-phenyl-3-[4-[[4-(4-phenylphenyl)phenyl]methyl]phenyl]carbazole
CID 157272513
3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
CID 20685483
3-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 90085403
3-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 118268216
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-(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
9-(4-phenylphenyl)-3-[4-[4-[(4-phenylphenyl)methyl]phenyl]phenyl]carbazole
CID 158819686
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-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole?
The IUPAC name of 3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole (CID 146661084) is 3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole.
What is the SMILES notation for 3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole?
The canonical SMILES for 3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole is C(=C(/Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1)c1ccccc1)\c1ccccc1.
What is the InChIKey of 3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole?
The InChIKey is HNQZZDAQZXJPEH-CLIDGEQKSA-N. The full InChI is InChI=1S/C39H29N/c1-4-12-29(13-5-1)26-34(31-14-6-2-7-15-31)27-30-20-22-32(23-21-30)33-24-25-39-37(28-33)36-18-10-11-19-38(36)40(39)35-16-8-3-9-17-35/h1-26,28H,27H2/b34-26-.
What are the key properties of 3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole?
3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole has a molecular weight of 511.67 g/mol, XLogP of 10.23, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole is sourced from PubChem (CID 146661084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).