6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline

C40H24N4 — CID 45276790

IUPAC6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline
SMILESc1ccc2cc(-c3nc4ccccc4c4cc5ccccc5n34)c(-c3nc4ccccc4c4cc5ccccc5n34)cc2c1
InChIInChI=1S/C40H24N4/c1-2-12-26-22-32(40-42-34-18-8-6-16-30(34)38-24-28-14-4-10-20-36(28)44(38)40)31(21-25(26)11-1)39-41-33-17-7-5-15-29(33)37-23-27-13-3-9-19-35(27)43(37)39/h1-24H
InChIKeyUBDKFJXHPAGKIW-UHFFFAOYSA-N
MW560.66 g/mol
LogP10.08
Rot. Bonds2

About 6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline

6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline (PubChem CID 45276790) has the molecular formula C40H24N4 and a molecular weight of 560.66 g/mol. Its IUPAC name is 6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline.

Molecular Properties

Compound Name6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline
PubChem CID45276790
Molecular FormulaC40H24N4
Molecular Weight560.66 g/mol
Exact Mass560.20
IUPAC Name6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline
SMILESc1ccc2cc(-c3nc4ccccc4c4cc5ccccc5n34)c(-c3nc4ccccc4c4cc5ccccc5n34)cc2c1
InChIInChI=1S/C40H24N4/c1-2-12-26-22-32(40-42-34-18-8-6-16-30(34)38-24-28-14-4-10-20-36(28)44(38)40)31(21-25(26)11-1)39-41-33-17-7-5-15-29(33)37-23-27-13-3-9-19-35(27)43(37)39/h1-24H
InChIKeyUBDKFJXHPAGKIW-UHFFFAOYSA-N
XLogP10.08
TPSA34.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500560.66
LogP ≤ 510.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline?
The IUPAC name of 6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline (CID 45276790) is 6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline.
What is the SMILES notation for 6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline?
The canonical SMILES for 6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline is c1ccc2cc(-c3nc4ccccc4c4cc5ccccc5n34)c(-c3nc4ccccc4c4cc5ccccc5n34)cc2c1.
What is the InChIKey of 6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline?
The InChIKey is UBDKFJXHPAGKIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H24N4/c1-2-12-26-22-32(40-42-34-18-8-6-16-30(34)38-24-28-14-4-10-20-36(28)44(38)40)31(21-25(26)11-1)39-41-33-17-7-5-15-29(33)37-23-27-13-3-9-19-35(27)43(37)39/h1-24H.
What are the key properties of 6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline?
6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline has a molecular weight of 560.66 g/mol, XLogP of 10.08, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline is sourced from PubChem (CID 45276790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).