3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole

C48H33N — CID 134504611

IUPAC3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole
SMILESC(=C(/c1ccccc1)c1ccc(-c2cccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c2)c2ccccc12)\c1ccccc1
InChIInChI=1S/C48H33N/c1-4-15-34(16-5-1)31-45(35-17-6-2-7-18-35)43-29-28-40(41-23-10-11-24-42(41)43)38-20-14-19-36(32-38)37-27-30-48-46(33-37)44-25-12-13-26-47(44)49(48)39-21-8-3-9-22-39/h1-33H/b45-31-
InChIKeyJLCRAVSTDXXLJG-GGZAYICLSA-N
MW623.80 g/mol
LogP12.86
Rot. Bonds6

About 3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole

3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole (PubChem CID 134504611) has the molecular formula C48H33N and a molecular weight of 623.80 g/mol. Its IUPAC name is 3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole
PubChem CID134504611
Molecular FormulaC48H33N
Molecular Weight623.80 g/mol
Exact Mass623.26
IUPAC Name3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole
SMILESC(=C(/c1ccccc1)c1ccc(-c2cccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c2)c2ccccc12)\c1ccccc1
InChIInChI=1S/C48H33N/c1-4-15-34(16-5-1)31-45(35-17-6-2-7-18-35)43-29-28-40(41-23-10-11-24-42(41)43)38-20-14-19-36(32-38)37-27-30-48-46(33-37)44-25-12-13-26-47(44)49(48)39-21-8-3-9-22-39/h1-33H/b45-31-
InChIKeyJLCRAVSTDXXLJG-GGZAYICLSA-N
XLogP12.86
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500623.80
LogP ≤ 512.86
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

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-[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
9-phenyl-3-[2-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-phenyl-3-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-phenyl-3-[2-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole;9-phenyl-3-[2-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole;9-phenyl-3-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole;9-phenyl-3-[3-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole;9-phenyl-3-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole
CID 160831831
3-(9-phenylcarbazol-3-yl)-9-[4-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590601
3-[4-[(E)-2-[4-[9,9-dimethyl-7-(7,9,9-trimethylfluoren-2-yl)fluoren-2-yl]phenyl]-1-phenylethenyl]phenyl]-9-phenylcarbazole
CID 59236111
3-[9-[4-(3-fluoranthen-3-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 71291349
3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole
CID 146661084
9-phenyl-3-[8-(9-phenylcarbazol-3-yl)-10-(3-phenylphenyl)anthracen-1-yl]carbazole
CID 155333092
3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[4-[4-[4-[3-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590322
3,9-diphenyl-6-[3-(9-phenylcarbazol-3-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 122492191
3-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9-(3-phenylphenyl)carbazole;3-[3-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-9-(3-phenylphenyl)carbazole;3-[4-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-9-(3-phenylphenyl)carbazole
CID 158212129
3-(9-phenylcarbazol-3-yl)-9-[2-[3-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590325

Frequently Asked Questions

What is the IUPAC name of 3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole?
The IUPAC name of 3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole (CID 134504611) is 3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole.
What is the SMILES notation for 3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole?
The canonical SMILES for 3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole is C(=C(/c1ccccc1)c1ccc(-c2cccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c2)c2ccccc12)\c1ccccc1.
What is the InChIKey of 3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole?
The InChIKey is JLCRAVSTDXXLJG-GGZAYICLSA-N. The full InChI is InChI=1S/C48H33N/c1-4-15-34(16-5-1)31-45(35-17-6-2-7-18-35)43-29-28-40(41-23-10-11-24-42(41)43)38-20-14-19-36(32-38)37-27-30-48-46(33-37)44-25-12-13-26-47(44)49(48)39-21-8-3-9-22-39/h1-33H/b45-31-.
What are the key properties of 3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole?
3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole has a molecular weight of 623.80 g/mol, XLogP of 12.86, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[4-[(Z)-1,2-diphenylethenyl]naphthalen-1-yl]phenyl]-9-phenylcarbazole is sourced from PubChem (CID 134504611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).