10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole

C40H26N2 — CID 118315120

IUPAC10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole
SMILESc1ccc(-n2ccc3ccc4c5ccccc5n(-c5ccc(-c6c7ccccc7cc7ccccc67)cc5)c4c32)cc1
InChIInChI=1S/C40H26N2/c1-2-12-31(13-3-1)41-25-24-28-20-23-36-35-16-8-9-17-37(35)42(40(36)39(28)41)32-21-18-27(19-22-32)38-33-14-6-4-10-29(33)26-30-11-5-7-15-34(30)38/h1-26H
InChIKeyJWGJJWDGZFIPSS-UHFFFAOYSA-N
MW534.66 g/mol
LogP10.70
Rot. Bonds3

About 10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole

10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole (PubChem CID 118315120) has the molecular formula C40H26N2 and a molecular weight of 534.66 g/mol. Its IUPAC name is 10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole.

Molecular Properties

Compound Name10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole
PubChem CID118315120
Molecular FormulaC40H26N2
Molecular Weight534.66 g/mol
Exact Mass534.21
IUPAC Name10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole
SMILESc1ccc(-n2ccc3ccc4c5ccccc5n(-c5ccc(-c6c7ccccc7cc7ccccc67)cc5)c4c32)cc1
InChIInChI=1S/C40H26N2/c1-2-12-31(13-3-1)41-25-24-28-20-23-36-35-16-8-9-17-37(35)42(40(36)39(28)41)32-21-18-27(19-22-32)38-33-14-6-4-10-29(33)26-30-11-5-7-15-34(30)38/h1-26H
InChIKeyJWGJJWDGZFIPSS-UHFFFAOYSA-N
XLogP10.70
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500534.66
LogP ≤ 510.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]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-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]pyrrolo[2,3-a]carbazole
CID 118315994
1-(3,5-diphenylphenyl)-10-[4-[4-[1-(3,5-diphenylphenyl)pyrrolo[2,3-a]carbazol-10-yl]phenyl]phenyl]pyrrolo[2,3-a]carbazole
CID 90090913
1-phenyl-10-[3-phenyl-5-(1-phenylpyrrolo[2,3-a]carbazol-10-yl)phenyl]pyrrolo[2,3-a]carbazole
CID 90090982
10-(3,5-diphenylphenyl)-1-phenylpyrrolo[2,3-a]carbazole
CID 90371617
1-(4-isoquinolin-4-ylphenyl)-10-phenylpyrrolo[2,3-a]carbazole
CID 123457400
1-phenyl-10-[3-(2-phenylcarbazol-9-yl)phenyl]pyrrolo[2,3-a]carbazole
CID 118315161
naphthalen-2-yl-[4-(1-phenylpyrrolo[2,3-a]carbazol-10-yl)phenyl]methanone
CID 118315145
1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole
CID 90062409
10-phenyl-1-[4-[6-(4-phenylphenyl)dibenzothiophen-4-yl]phenyl]pyrrolo[2,3-a]carbazole
CID 118316007
20-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-phenyl-5,20-diazapentacyclo[11.7.0.02,10.04,8.014,19]icosa-1(13),2,4(8),6,9,11,14,16,18-nonaene
CID 90222913
20-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-5-phenyl-5,20-diazapentacyclo[11.7.0.02,10.04,8.014,19]icosa-1(13),2,4(8),6,9,11,14,16,18-nonaene
CID 90222919
N-[9-(4-methylphenyl)carbazol-3-yl]-N,1,10-triphenylpyrrolo[2,3-a]carbazol-7-amine
CID 118316091

Frequently Asked Questions

What is the IUPAC name of 10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole?
The IUPAC name of 10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole (CID 118315120) is 10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole.
What is the SMILES notation for 10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole?
The canonical SMILES for 10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole is c1ccc(-n2ccc3ccc4c5ccccc5n(-c5ccc(-c6c7ccccc7cc7ccccc67)cc5)c4c32)cc1.
What is the InChIKey of 10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole?
The InChIKey is JWGJJWDGZFIPSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H26N2/c1-2-12-31(13-3-1)41-25-24-28-20-23-36-35-16-8-9-17-37(35)42(40(36)39(28)41)32-21-18-27(19-22-32)38-33-14-6-4-10-29(33)26-30-11-5-7-15-34(30)38/h1-26H.
What are the key properties of 10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole?
10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole has a molecular weight of 534.66 g/mol, XLogP of 10.70, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4-anthracen-9-ylphenyl)-1-phenylpyrrolo[2,3-a]carbazole is sourced from PubChem (CID 118315120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).