9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole

C44H29N — CID 141374936

IUPAC9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole
SMILESc1ccc(-c2c3ccccc3cc3c(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4)cccc23)cc1
InChIInChI=1S/C44H29N/c1-3-12-32(13-4-1)44-37-17-8-7-14-34(37)29-40-36(19-11-20-39(40)44)31-24-22-30(23-25-31)33-26-27-43-41(28-33)38-18-9-10-21-42(38)45(43)35-15-5-2-6-16-35/h1-29H
InChIKeyCOVQIOUVXOKMEV-UHFFFAOYSA-N
MW571.72 g/mol
LogP12.09
Rot. Bonds4

About 9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole

9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole (PubChem CID 141374936) has the molecular formula C44H29N and a molecular weight of 571.72 g/mol. Its IUPAC name is 9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole
PubChem CID141374936
Molecular FormulaC44H29N
Molecular Weight571.72 g/mol
Exact Mass571.23
IUPAC Name9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole
SMILESc1ccc(-c2c3ccccc3cc3c(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4)cccc23)cc1
InChIInChI=1S/C44H29N/c1-3-12-32(13-4-1)44-37-17-8-7-14-34(37)29-40-36(19-11-20-39(40)44)31-24-22-30(23-25-31)33-26-27-43-41(28-33)38-18-9-10-21-42(38)45(43)35-15-5-2-6-16-35/h1-29H
InChIKeyCOVQIOUVXOKMEV-UHFFFAOYSA-N
XLogP12.09
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500571.72
LogP ≤ 512.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

3-(4-phenanthren-9-ylphenyl)-9-phenylcarbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;9-phenyl-3-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 159711358
9-phenyl-3-[8-(9-phenylcarbazol-3-yl)-10-(3-phenylphenyl)anthracen-1-yl]carbazole
CID 155333092
4-(4-naphthalen-1-ylphenyl)-N-[4-(10-phenylanthracen-9-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 59282036
3-[9,10-dinaphthalen-1-yl-6-(9-phenylcarbazol-3-yl)anthracen-2-yl]-9-phenylcarbazole;2-naphthalen-1-yl-6,9,10-triphenylanthracene;2,9,10-trinaphthalen-1-yl-6-phenylanthracene
CID 160576501
9-[3-[3-[5-(4-carbazol-9-ylphenyl)anthracen-1-yl]phenyl]phenyl]carbazole;3-phenyl-9-[4-[5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]carbazole
CID 160946049
3-(4-benzo[a]anthracen-7-ylphenyl)-9-phenylcarbazole
CID 121309011
3-[10-(4,5-diphenylanthracen-9-yl)-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]-9-phenylcarbazole
CID 155333594
N-(4-naphthalen-1-ylphenyl)-N-[4-(10-phenylanthracen-9-yl)phenyl]-4-(9-phenylcarbazol-3-yl)aniline;N-[4-(10-phenylanthracen-9-yl)phenyl]-4-(9-phenylcarbazol-3-yl)-N-[4-(2-phenylphenyl)phenyl]aniline;N-[4-(10-phenylanthracen-9-yl)phenyl]-4-(9-phenylcarbazol-3-yl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 160771510
9-phenyl-3-[4-[10-[4-(9-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]carbazole;9-phenyl-3-[4-[4-[10-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]carbazole
CID 158416546
3,6-dinaphthalen-1-yl-9-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazole;3,6-dinaphthalen-2-yl-9-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazole;9-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]-3,6-bis(2-phenylphenyl)carbazole
CID 161091193
3-(3-phenylphenyl)-9-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]carbazole;3-(3-phenylphenyl)-9-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]carbazole
CID 157065974
3,9-bis(4-naphthalen-1-ylphenyl)carbazole;3-(4-naphthalen-1-ylphenyl)-9-(3-phenylphenyl)carbazole
CID 157309871

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole?
The IUPAC name of 9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole (CID 141374936) is 9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole.
What is the SMILES notation for 9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole?
The canonical SMILES for 9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole is c1ccc(-c2c3ccccc3cc3c(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4)cccc23)cc1.
What is the InChIKey of 9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole?
The InChIKey is COVQIOUVXOKMEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H29N/c1-3-12-32(13-4-1)44-37-17-8-7-14-34(37)29-40-36(19-11-20-39(40)44)31-24-22-30(23-25-31)33-26-27-43-41(28-33)38-18-9-10-21-42(38)45(43)35-15-5-2-6-16-35/h1-29H.
What are the key properties of 9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole?
9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole has a molecular weight of 571.72 g/mol, XLogP of 12.09, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-3-[4-(10-phenylanthracen-1-yl)phenyl]carbazole is sourced from PubChem (CID 141374936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).