6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline

C41H26N4 — CID 145180197

IUPAC6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline
SMILESc1ccc(-c2nc(-c3ccc(-c4ccc(-c5nc6ccccc6n6c5cc5ccccc56)cc4)cc3)nc3ccccc23)cc1
InChIInChI=1S/C41H26N4/c1-2-10-29(11-3-1)39-33-13-5-6-14-34(33)43-41(44-39)31-24-20-28(21-25-31)27-18-22-30(23-19-27)40-38-26-32-12-4-8-16-36(32)45(38)37-17-9-7-15-35(37)42-40/h1-26H
InChIKeyPIXSXRVUXGHEOF-UHFFFAOYSA-N
MW574.69 g/mol
LogP10.25
Rot. Bonds4

About 6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline

6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline (PubChem CID 145180197) has the molecular formula C41H26N4 and a molecular weight of 574.69 g/mol. Its IUPAC name is 6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline.

Molecular Properties

Compound Name6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline
PubChem CID145180197
Molecular FormulaC41H26N4
Molecular Weight574.69 g/mol
Exact Mass574.22
IUPAC Name6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline
SMILESc1ccc(-c2nc(-c3ccc(-c4ccc(-c5nc6ccccc6n6c5cc5ccccc56)cc4)cc3)nc3ccccc23)cc1
InChIInChI=1S/C41H26N4/c1-2-10-29(11-3-1)39-33-13-5-6-14-34(33)43-41(44-39)31-24-20-28(21-25-31)27-18-22-30(23-19-27)40-38-26-32-12-4-8-16-36(32)45(38)37-17-9-7-15-35(37)42-40/h1-26H
InChIKeyPIXSXRVUXGHEOF-UHFFFAOYSA-N
XLogP10.25
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.69
LogP ≤ 510.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline 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

6-[3-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]indolo[1,2-a]quinoxaline
CID 145180162
6-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[1,2-a]quinoxaline
CID 145180354
26-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]-2,26-diazaheptacyclo[15.11.0.02,10.03,8.011,16.019,27.020,25]octacosa-1(28),3,5,7,9,11,13,15,17,19(27),20,22,24-tridecaene
CID 90432173
6-[4-[3-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline
CID 145180375
6-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]indolo[1,2-a]quinoxaline
CID 145180592
4-phenyl-2-[3-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]quinazoline
CID 155156227
2-[4-(4-phenylphenyl)phenyl]-4-[3-[3-[4-[4-(4-phenylphenyl)phenyl]quinazolin-2-yl]phenyl]phenyl]quinazoline
CID 146825143
2-(3,5-diphenylphenyl)-4-phenylquinazoline
CID 155283512
3-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole
CID 118067271
6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]benzo[k]phenanthridine
CID 122665395
2-(4-phenanthren-2-ylphenyl)-4-[4-[2-(4-phenanthren-2-ylphenyl)quinazolin-4-yl]phenyl]quinazoline
CID 163813527
6-(4-dibenzothiophen-4-ylphenyl)indolo[1,2-a]quinoxaline
CID 145180261

Frequently Asked Questions

What is the IUPAC name of 6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline?
The IUPAC name of 6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline (CID 145180197) is 6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline.
What is the SMILES notation for 6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline?
The canonical SMILES for 6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline is c1ccc(-c2nc(-c3ccc(-c4ccc(-c5nc6ccccc6n6c5cc5ccccc56)cc4)cc3)nc3ccccc23)cc1.
What is the InChIKey of 6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline?
The InChIKey is PIXSXRVUXGHEOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H26N4/c1-2-10-29(11-3-1)39-33-13-5-6-14-34(33)43-41(44-39)31-24-20-28(21-25-31)27-18-22-30(23-19-27)40-38-26-32-12-4-8-16-36(32)45(38)37-17-9-7-15-35(37)42-40/h1-26H.
What are the key properties of 6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline?
6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline has a molecular weight of 574.69 g/mol, XLogP of 10.25, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]indolo[1,2-a]quinoxaline is sourced from PubChem (CID 145180197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).