9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole

C43H31N3 — CID 91518473

IUPAC9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole
SMILESCC12C=CC=CC1N(c1cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c1)c1ccccc12
InChIInChI=1S/C43H31N3/c1-43-25-13-12-24-42(43)46(41-23-11-6-18-36(41)43)31-27-29(44-37-19-7-2-14-32(37)33-15-3-8-20-38(33)44)26-30(28-31)45-39-21-9-4-16-34(39)35-17-5-10-22-40(35)45/h2-28,42H,1H3
InChIKeyFRPFHRNNJIZLBN-UHFFFAOYSA-N
MW589.74 g/mol
LogP10.78
Rot. Bonds3

About 9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole

9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole (PubChem CID 91518473) has the molecular formula C43H31N3 and a molecular weight of 589.74 g/mol. Its IUPAC name is 9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole.

Molecular Properties

Compound Name9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole
PubChem CID91518473
Molecular FormulaC43H31N3
Molecular Weight589.74 g/mol
Exact Mass589.25
IUPAC Name9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole
SMILESCC12C=CC=CC1N(c1cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c1)c1ccccc12
InChIInChI=1S/C43H31N3/c1-43-25-13-12-24-42(43)46(41-23-11-6-18-36(41)43)31-27-29(44-37-19-7-2-14-32(37)33-15-3-8-20-38(33)44)26-30(28-31)45-39-21-9-4-16-34(39)35-17-5-10-22-40(35)45/h2-28,42H,1H3
InChIKeyFRPFHRNNJIZLBN-UHFFFAOYSA-N
XLogP10.78
TPSA13.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500589.74
LogP ≤ 510.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]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

9-[3-(4b-methyl-8aH-carbazol-9-yl)phenyl]-3-carbazol-9-ylcarbazole
CID 165037523
3-(4a,4b-dimethyl-8a,9a-dihydrocarbazol-9-yl)-9-[3-(4b-methyl-8aH-carbazol-9-yl)phenyl]-3-methyl-4H-carbazole
CID 163729639
4-[3-[6-[3-(4b-methyl-8aH-carbazol-9-yl)carbazol-9-yl]-2-pyridinyl]phenyl]furo[2,3-b]indole
CID 163785582
4b-methyl-9-phenyl-8aH-carbazol-3-amine
CID 129311124
9-[3-[5-(2-carbazol-9-ylphenyl)-2-cyanophenyl]-2-cyanophenyl]-4b-methyl-8aH-carbazole-3-carbonitrile
CID 167280750
4b-methyl-9-(3-oxaheptacyclo[15.12.0.02,14.04,13.06,11.018,23.024,29]nonacosa-1(17),2(14),4(13),5,7,9,11,15,18,20,22,24,26,28-tetradecaen-9-yl)-8aH-carbazole
CID 165103646
10-[3,5-di(carbazol-9-yl)phenyl]-9,9-dimethylacridine
CID 58609318
3-(4b-methyl-8aH-carbazol-9-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]-6-(2,4,6-trimethylphenyl)carbazole
CID 146521279
2-(4b-methyl-8aH-carbazol-9-yl)-3-(12-phenyl-[1]benzothiolo[2,3-a]carbazol-8-yl)benzonitrile
CID 126597100
5-[4-[4-(4b-methyl-9-phenyl-8aH-carbazol-2-yl)-6-dibenzofuran-2-yl-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-2-yl]benzo[b]carbazole
CID 167043609
5-([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-(4b-methyl-8aH-carbazol-9-yl)phenyl]cyclohexa-1,5-diene-1-carbonitrile
CID 155299841
9-[2-(4b-methyl-8aH-carbazol-9-yl)-2-methyl-1H-dibenzofuran-4-yl]carbazole
CID 163921758

Frequently Asked Questions

What is the IUPAC name of 9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole?
The IUPAC name of 9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole (CID 91518473) is 9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole.
What is the SMILES notation for 9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole?
The canonical SMILES for 9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole is CC12C=CC=CC1N(c1cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c1)c1ccccc12.
What is the InChIKey of 9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole?
The InChIKey is FRPFHRNNJIZLBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H31N3/c1-43-25-13-12-24-42(43)46(41-23-11-6-18-36(41)43)31-27-29(44-37-19-7-2-14-32(37)33-15-3-8-20-38(33)44)26-30(28-31)45-39-21-9-4-16-34(39)35-17-5-10-22-40(35)45/h2-28,42H,1H3.
What are the key properties of 9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole?
9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole has a molecular weight of 589.74 g/mol, XLogP of 10.78, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-(4b-methyl-8aH-carbazol-9-yl)-5-carbazol-9-ylphenyl]carbazole is sourced from PubChem (CID 91518473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).