11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole

C46H30N2 — CID 167029799

IUPAC11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccc(-c4ccccc4)c4ccccc34)cc2)cc1
InChIInChI=1S/C46H30N2/c1-3-13-31(14-4-1)32-23-25-34(26-24-32)47-42-21-11-9-19-38(42)40-30-46-41(29-45(40)47)39-20-10-12-22-43(39)48(46)44-28-27-35(33-15-5-2-6-16-33)36-17-7-8-18-37(36)44/h1-30H
InChIKeyZWMQRJWDPJYYLS-UHFFFAOYSA-N
MW610.76 g/mol
LogP12.37
Rot. Bonds4

About 11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole

11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole (PubChem CID 167029799) has the molecular formula C46H30N2 and a molecular weight of 610.76 g/mol. Its IUPAC name is 11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole.

Molecular Properties

Compound Name11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole
PubChem CID167029799
Molecular FormulaC46H30N2
Molecular Weight610.76 g/mol
Exact Mass610.24
IUPAC Name11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccc(-c4ccccc4)c4ccccc34)cc2)cc1
InChIInChI=1S/C46H30N2/c1-3-13-31(14-4-1)32-23-25-34(26-24-32)47-42-21-11-9-19-38(42)40-30-46-41(29-45(40)47)39-20-10-12-22-43(39)48(46)44-28-27-35(33-15-5-2-6-16-33)36-17-7-8-18-37(36)44/h1-30H
InChIKeyZWMQRJWDPJYYLS-UHFFFAOYSA-N
XLogP12.37
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms48
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500610.76
LogP ≤ 512.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]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

Frequently Asked Questions

What is the IUPAC name of 11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole?
The IUPAC name of 11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole (CID 167029799) is 11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole.
What is the SMILES notation for 11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole?
The canonical SMILES for 11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole is c1ccc(-c2ccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccc(-c4ccccc4)c4ccccc34)cc2)cc1.
What is the InChIKey of 11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole?
The InChIKey is ZWMQRJWDPJYYLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30N2/c1-3-13-31(14-4-1)32-23-25-34(26-24-32)47-42-21-11-9-19-38(42)40-30-46-41(29-45(40)47)39-20-10-12-22-43(39)48(46)44-28-27-35(33-15-5-2-6-16-33)36-17-7-8-18-37(36)44/h1-30H.
What are the key properties of 11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole?
11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole has a molecular weight of 610.76 g/mol, XLogP of 12.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole is sourced from PubChem (CID 167029799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).