9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole

C42H32N2 — CID 143467653

IUPAC9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole
SMILESCCc1cc2c(-n3c4ccccc4c4ccccc43)c3ccccc3c(-n3c4ccccc4c4ccccc43)c2cc1CC
InChIInChI=1S/C42H32N2/c1-3-27-25-35-36(26-28(27)4-2)42(44-39-23-13-9-17-31(39)32-18-10-14-24-40(32)44)34-20-6-5-19-33(34)41(35)43-37-21-11-7-15-29(37)30-16-8-12-22-38(30)43/h5-26H,3-4H2,1-2H3
InChIKeyKIQISHQVQJUKHH-UHFFFAOYSA-N
MW564.73 g/mol
LogP11.31
Rot. Bonds4

About 9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole

9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole (PubChem CID 143467653) has the molecular formula C42H32N2 and a molecular weight of 564.73 g/mol. Its IUPAC name is 9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole.

Molecular Properties

Compound Name9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole
PubChem CID143467653
Molecular FormulaC42H32N2
Molecular Weight564.73 g/mol
Exact Mass564.26
IUPAC Name9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole
SMILESCCc1cc2c(-n3c4ccccc4c4ccccc43)c3ccccc3c(-n3c4ccccc4c4ccccc43)c2cc1CC
InChIInChI=1S/C42H32N2/c1-3-27-25-35-36(26-28(27)4-2)42(44-39-23-13-9-17-31(39)32-18-10-14-24-40(32)44)34-20-6-5-19-33(34)41(35)43-37-21-11-7-15-29(37)30-16-8-12-22-38(30)43/h5-26H,3-4H2,1-2H3
InChIKeyKIQISHQVQJUKHH-UHFFFAOYSA-N
XLogP11.31
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500564.73
LogP ≤ 511.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

10-carbazol-9-ylanthracene-9-carbaldehyde
CID 134598541
9-[2,3,4,5-tetra(carbazol-9-yl)-6-methylphenyl]carbazole
CID 147406745
9-(10-phenylanthracen-9-yl)-3-[9-(10-phenylanthracen-9-yl)carbazol-3-yl]carbazole
CID 168729209
5,11-bis(3-ethylphenyl)indolo[3,2-b]carbazole
CID 130417419
5,12-bis(2,4,6-tripropylphenyl)quinolino[2,3-b]acridine-7,14-dione
CID 167209555
19-[10-(19-azapentacyclo[14.2.1.05,18.06,11.012,17]nonadeca-1,3,5(18),6,8,10,12(17),13,15-nonaen-19-yl)anthracen-9-yl]-19-azapentacyclo[14.2.1.05,18.06,11.012,17]nonadeca-1,3,5(18),6,8,10,12(17),13,15-nonaene
CID 88951403
1-ethyl-9-methylcarbazole
CID 21455608
9-phenyl-3-[9-(10-phenylanthracen-9-yl)carbazol-3-yl]carbazole
CID 168729215
N,N-diphenyl-4-[3-[9-[10-[3-[3-[4-(N-phenylanilino)phenyl]cyclobutyl]carbazol-9-yl]anthracen-9-yl]carbazol-3-yl]cyclobutyl]aniline
CID 22886942
1-carbazol-9-yl-2-methylbutan-1-one
CID 58981488
9-[2-(2,2-dimethylpropyl)phenyl]carbazole
CID 154939343
9-[4,7-di(carbazol-9-yl)benzo[a]anthracen-12-yl]carbazole
CID 59412616

Frequently Asked Questions

What is the IUPAC name of 9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole?
The IUPAC name of 9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole (CID 143467653) is 9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole.
What is the SMILES notation for 9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole?
The canonical SMILES for 9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole is CCc1cc2c(-n3c4ccccc4c4ccccc43)c3ccccc3c(-n3c4ccccc4c4ccccc43)c2cc1CC.
What is the InChIKey of 9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole?
The InChIKey is KIQISHQVQJUKHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H32N2/c1-3-27-25-35-36(26-28(27)4-2)42(44-39-23-13-9-17-31(39)32-18-10-14-24-40(32)44)34-20-6-5-19-33(34)41(35)43-37-21-11-7-15-29(37)30-16-8-12-22-38(30)43/h5-26H,3-4H2,1-2H3.
What are the key properties of 9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole?
9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole has a molecular weight of 564.73 g/mol, XLogP of 11.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(10-carbazol-9-yl-2,3-diethylanthracen-9-yl)carbazole is sourced from PubChem (CID 143467653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).