1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one

C110H92N8O12 — CID 158503855

IUPAC1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one
SMILESCCc1c(CC(=O)Cc2ccc(C)cc2)ccc2nc(-c3ccco3)c(-c3ccco3)nc12.CCc1cc(CC(=O)Cc2ccc(C)cc2)cc2nc(-c3ccco3)c(-c3ccco3)nc12.CCc1cc2nc(-c3ccco3)c(-c3ccco3)nc2cc1CC(=O)Cc1ccc(C)cc1.Cc1ccc(CC(=O)Cc2ccc3nc(-c4ccco4)c(-c4ccco4)nc3c2)cc1
InChIInChI=1S/3C28H24N2O3.C26H20N2O3/c1-3-22-20(17-21(31)16-19-10-8-18(2)9-11-19)12-13-23-26(22)30-28(25-7-5-15-33-25)27(29-23)24-6-4-14-32-24;1-3-21-14-20(16-22(31)15-19-10-8-18(2)9-11-19)17-23-26(21)30-28(25-7-5-13-33-25)27(29-23)24-6-4-12-32-24;1-3-20-16-23-24(17-21(20)15-22(31)14-19-10-8-18(2)9-11-19)30-28(26-7-5-13-33-26)27(29-23)25-6-4-12-32-25;1-17-6-8-18(9-7-17)14-20(29)15-19-10-11-21-22(16-19)28-26(24-5-3-13-31-24)25(27-21)23-4-2-12-30-23/h4-15H,3,16-17H2,1-2H3;4-14,17H,3,15-16H2,1-2H3;4-13,16-17H,3,14-15H2,1-2H3;2-13,16H,14-15H2,1H3
InChIKeyHKFQKFFISYZMEI-UHFFFAOYSA-N
MW1717.99 g/mol
LogP24.94
Rot. Bonds27

About 1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one

1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one (PubChem CID 158503855) has the molecular formula C110H92N8O12 and a molecular weight of 1717.99 g/mol. Its IUPAC name is 1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one.

Molecular Properties

Compound Name1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one
PubChem CID158503855
Molecular FormulaC110H92N8O12
Molecular Weight1717.99 g/mol
Exact Mass1716.68
IUPAC Name1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one
SMILESCCc1c(CC(=O)Cc2ccc(C)cc2)ccc2nc(-c3ccco3)c(-c3ccco3)nc12.CCc1cc(CC(=O)Cc2ccc(C)cc2)cc2nc(-c3ccco3)c(-c3ccco3)nc12.CCc1cc2nc(-c3ccco3)c(-c3ccco3)nc2cc1CC(=O)Cc1ccc(C)cc1.Cc1ccc(CC(=O)Cc2ccc3nc(-c4ccco4)c(-c4ccco4)nc3c2)cc1
InChIInChI=1S/3C28H24N2O3.C26H20N2O3/c1-3-22-20(17-21(31)16-19-10-8-18(2)9-11-19)12-13-23-26(22)30-28(25-7-5-15-33-25)27(29-23)24-6-4-14-32-24;1-3-21-14-20(16-22(31)15-19-10-8-18(2)9-11-19)17-23-26(21)30-28(25-7-5-13-33-25)27(29-23)24-6-4-12-32-24;1-3-20-16-23-24(17-21(20)15-22(31)14-19-10-8-18(2)9-11-19)30-28(26-7-5-13-33-26)27(29-23)25-6-4-12-32-25;1-17-6-8-18(9-7-17)14-20(29)15-19-10-11-21-22(16-19)28-26(24-5-3-13-31-24)25(27-21)23-4-2-12-30-23/h4-15H,3,16-17H2,1-2H3;4-14,17H,3,15-16H2,1-2H3;4-13,16-17H,3,14-15H2,1-2H3;2-13,16H,14-15H2,1H3
InChIKeyHKFQKFFISYZMEI-UHFFFAOYSA-N
XLogP24.94
TPSA276.52 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds27
Heavy Atoms130
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001717.99
LogP ≤ 524.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one?
The IUPAC name of 1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one (CID 158503855) is 1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one.
What is the SMILES notation for 1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one?
The canonical SMILES for 1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one is CCc1c(CC(=O)Cc2ccc(C)cc2)ccc2nc(-c3ccco3)c(-c3ccco3)nc12.CCc1cc(CC(=O)Cc2ccc(C)cc2)cc2nc(-c3ccco3)c(-c3ccco3)nc12.CCc1cc2nc(-c3ccco3)c(-c3ccco3)nc2cc1CC(=O)Cc1ccc(C)cc1.Cc1ccc(CC(=O)Cc2ccc3nc(-c4ccco4)c(-c4ccco4)nc3c2)cc1.
What is the InChIKey of 1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one?
The InChIKey is HKFQKFFISYZMEI-UHFFFAOYSA-N. The full InChI is InChI=1S/3C28H24N2O3.C26H20N2O3/c1-3-22-20(17-21(31)16-19-10-8-18(2)9-11-19)12-13-23-26(22)30-28(25-7-5-15-33-25)27(29-23)24-6-4-14-32-24;1-3-21-14-20(16-22(31)15-19-10-8-18(2)9-11-19)17-23-26(21)30-28(25-7-5-13-33-25)27(29-23)24-6-4-12-32-24;1-3-20-16-23-24(17-21(20)15-22(31)14-19-10-8-18(2)9-11-19)30-28(26-7-5-13-33-26)27(29-23)25-6-4-12-32-25;1-17-6-8-18(9-7-17)14-20(29)15-19-10-11-21-22(16-19)28-26(24-5-3-13-31-24)25(27-21)23-4-2-12-30-23/h4-15H,3,16-17H2,1-2H3;4-14,17H,3,15-16H2,1-2H3;4-13,16-17H,3,14-15H2,1-2H3;2-13,16H,14-15H2,1H3.
What are the key properties of 1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one?
1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one has a molecular weight of 1717.99 g/mol, XLogP of 24.94, 27 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[5-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[7-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one;1-[8-ethyl-2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-(4-methylphenyl)propan-2-one is sourced from PubChem (CID 158503855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).