3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline

C38H30N4O2 — CID 58883088

IUPAC3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline
SMILESCOc1ccc(-c2nc3cc(C)ccc3nc2-c2ccc(-c3nc4ccc(C)cc4nc3-c3ccc(OC)cc3)cc2)cc1
InChIInChI=1S/C38H30N4O2/c1-23-5-19-31-33(21-23)41-37(27-11-15-29(43-3)16-12-27)35(39-31)25-7-9-26(10-8-25)36-38(28-13-17-30(44-4)18-14-28)42-34-22-24(2)6-20-32(34)40-36/h5-22H,1-4H3
InChIKeyBPBNLXDSPUTMAD-UHFFFAOYSA-N
MW574.68 g/mol
LogP8.88
Rot. Bonds6

About 3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline

3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline (PubChem CID 58883088) has the molecular formula C38H30N4O2 and a molecular weight of 574.68 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline
PubChem CID58883088
Molecular FormulaC38H30N4O2
Molecular Weight574.68 g/mol
Exact Mass574.24
IUPAC Name3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline
SMILESCOc1ccc(-c2nc3cc(C)ccc3nc2-c2ccc(-c3nc4ccc(C)cc4nc3-c3ccc(OC)cc3)cc2)cc1
InChIInChI=1S/C38H30N4O2/c1-23-5-19-31-33(21-23)41-37(27-11-15-29(43-3)16-12-27)35(39-31)25-7-9-26(10-8-25)36-38(28-13-17-30(44-4)18-14-28)42-34-22-24(2)6-20-32(34)40-36/h5-22H,1-4H3
InChIKeyBPBNLXDSPUTMAD-UHFFFAOYSA-N
XLogP8.88
TPSA70.02 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.68
LogP ≤ 58.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline 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

2,3,8,9-tetrakis(4-methoxyphenyl)pyrazino[2,3-f]quinoxaline
CID 15620164
2,3-bis(4-methoxyphenyl)naphtho[2,3-g]quinoxaline
CID 121258930
6-chloro-2-(4-methoxyphenyl)-3-phenylquinoxaline
CID 118726434
2,3-bis(4-methoxyphenyl)naphtho[2,3-g]quinoxaline;methane
CID 145053980
2,3-bis(4-methoxyphenyl)-5,6-dimethylpyrazine
CID 14100167
6-methoxy-3-methyl-2-phenylquinoxaline
CID 15500862
N-[2,3-bis(4-methoxyphenyl)quinoxalin-6-yl]-N-methylsulfonylmethanesulfonamide
CID 70654333
1-(113C)methoxy-4-methylbenzene
CID 166176950
9-methoxy-2-methyl-6-phenylphenanthridine
CID 50902217
2,3-bis(4-methoxyphenyl)-6-(methylsulfonylmethyl)quinoxaline
CID 148501353
6-methoxy-3-methyl-2-(4-methylphenyl)-4-phenylquinoline
CID 56958029
methane;1-methoxy-4-(4-methylphenyl)benzene
CID 159881054

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline?
The IUPAC name of 3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline (CID 58883088) is 3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline.
What is the SMILES notation for 3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline?
The canonical SMILES for 3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline is COc1ccc(-c2nc3cc(C)ccc3nc2-c2ccc(-c3nc4ccc(C)cc4nc3-c3ccc(OC)cc3)cc2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline?
The InChIKey is BPBNLXDSPUTMAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H30N4O2/c1-23-5-19-31-33(21-23)41-37(27-11-15-29(43-3)16-12-27)35(39-31)25-7-9-26(10-8-25)36-38(28-13-17-30(44-4)18-14-28)42-34-22-24(2)6-20-32(34)40-36/h5-22H,1-4H3.
What are the key properties of 3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline?
3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline has a molecular weight of 574.68 g/mol, XLogP of 8.88, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline is sourced from PubChem (CID 58883088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).