7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide

C231H235N37O38 — CID 159505325

IUPAC7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide
SMILESCOc1cc2c(cc1-c1c(C)coc1C)ncc1c2n(C(C)c2ccccn2)c(=O)n1CC(=O)CCCCC(=O)Cn1c(=O)n(C(C)c2ccccn2)c2c3cc(OC)c(-c4c(C)noc4C)cc3ncc21.COc1cc2c(cc1-c1c(C)coc1C)ncc1c2n(C(C)c2ccccn2)c(=O)n1CC(=O)CCCOCCCC(=O)Cn1c(=O)n(C(C)c2ccccn2)c2c3cc(OC)c(-c4c(C)noc4C)cc3ncc21.COc1cc2c(cc1-c1c(C)coc1C)ncc1c2n(C(C)c2ccccn2)c(=O)n1CC(=O)CCCOCCOCCOCCCC(=O)Cn1c(=O)n(C(C)c2ccccn2)c2c3cc(OC)c(-c4c(C)noc4C)cc3ncc21.COc1cc2c(cc1-c1c(C)coc1C)ncc1c2n(C(C)c2ccccn2)c(=O)n1CC(=O)NCCOCCOCCCC(=O)Cn1c(=O)n(C(C)c2ccccn2)c2c3cc(OC)c(-c4c(C)noc4C)cc3ncc21
InChIInChI=1S/C61H65N9O11.C58H60N10O10.C57H57N9O9.C55H53N9O8/c1-36-35-80-40(5)56(36)46-27-50-44(29-54(46)75-7)58-52(31-64-50)67(60(73)69(58)38(3)48-17-9-11-19-62-48)33-42(71)15-13-21-77-23-25-79-26-24-78-22-14-16-43(72)34-68-53-32-65-51-28-47(57-37(2)66-81-41(57)6)55(76-8)30-45(51)59(53)70(61(68)74)39(4)49-18-10-12-20-63-49;1-33-32-77-37(5)53(33)42-24-46-40(26-50(42)73-7)56-49(29-63-46)66(58(72)68(56)36(4)45-16-10-12-18-60-45)31-52(70)61-19-21-76-23-22-75-20-13-14-39(69)30-65-48-28-62-47-25-43(54-34(2)64-78-38(54)6)51(74-8)27-41(47)55(48)67(57(65)71)35(3)44-15-9-11-17-59-44;1-32-31-74-36(5)52(32)42-23-46-40(25-50(42)71-7)54-48(27-60-46)63(56(69)65(54)34(3)44-17-9-11-19-58-44)29-38(67)15-13-21-73-22-14-16-39(68)30-64-49-28-61-47-24-43(53-33(2)62-75-37(53)6)51(72-8)26-41(47)55(49)66(57(64)70)35(4)45-18-10-12-20-59-45;1-30-29-71-34(5)50(30)40-21-44-38(23-48(40)69-7)52-46(25-58-44)61(54(67)63(52)32(3)42-17-11-13-19-56-42)27-36(65)15-9-10-16-37(66)28-62-47-26-59-45-22-41(51-31(2)60-72-35(51)6)49(70-8)24-39(45)53(47)64(55(62)68)33(4)43-18-12-14-20-57-43/h9-12,17-20,27-32,35,38-39H,13-16,21-26,33-34H2,1-8H3;9-12,15-18,24-29,32,35-36H,13-14,19-23,30-31H2,1-8H3,(H,61,70);9-12,17-20,23-28,31,34-35H,13-16,21-22,29-30H2,1-8H3;11-14,17-26,29,32-33H,9-10,15-16,27-28H2,1-8H3
InChIKeyLZXJMFFIQTXCIX-UHFFFAOYSA-N
MW4137.64 g/mol
LogP37.22
Rot. Bonds85

About 7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide

7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide (PubChem CID 159505325) has the molecular formula C231H235N37O38 and a molecular weight of 4137.64 g/mol. Its IUPAC name is 7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide.

Molecular Properties

Compound Name7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide
PubChem CID159505325
Molecular FormulaC231H235N37O38
Molecular Weight4137.64 g/mol
Exact Mass4134.76
IUPAC Name7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide
SMILESCOc1cc2c(cc1-c1c(C)coc1C)ncc1c2n(C(C)c2ccccn2)c(=O)n1CC(=O)CCCCC(=O)Cn1c(=O)n(C(C)c2ccccn2)c2c3cc(OC)c(-c4c(C)noc4C)cc3ncc21.COc1cc2c(cc1-c1c(C)coc1C)ncc1c2n(C(C)c2ccccn2)c(=O)n1CC(=O)CCCOCCCC(=O)Cn1c(=O)n(C(C)c2ccccn2)c2c3cc(OC)c(-c4c(C)noc4C)cc3ncc21.COc1cc2c(cc1-c1c(C)coc1C)ncc1c2n(C(C)c2ccccn2)c(=O)n1CC(=O)CCCOCCOCCOCCCC(=O)Cn1c(=O)n(C(C)c2ccccn2)c2c3cc(OC)c(-c4c(C)noc4C)cc3ncc21.COc1cc2c(cc1-c1c(C)coc1C)ncc1c2n(C(C)c2ccccn2)c(=O)n1CC(=O)NCCOCCOCCCC(=O)Cn1c(=O)n(C(C)c2ccccn2)c2c3cc(OC)c(-c4c(C)noc4C)cc3ncc21
InChIInChI=1S/C61H65N9O11.C58H60N10O10.C57H57N9O9.C55H53N9O8/c1-36-35-80-40(5)56(36)46-27-50-44(29-54(46)75-7)58-52(31-64-50)67(60(73)69(58)38(3)48-17-9-11-19-62-48)33-42(71)15-13-21-77-23-25-79-26-24-78-22-14-16-43(72)34-68-53-32-65-51-28-47(57-37(2)66-81-41(57)6)55(76-8)30-45(51)59(53)70(61(68)74)39(4)49-18-10-12-20-63-49;1-33-32-77-37(5)53(33)42-24-46-40(26-50(42)73-7)56-49(29-63-46)66(58(72)68(56)36(4)45-16-10-12-18-60-45)31-52(70)61-19-21-76-23-22-75-20-13-14-39(69)30-65-48-28-62-47-25-43(54-34(2)64-78-38(54)6)51(74-8)27-41(47)55(48)67(57(65)71)35(3)44-15-9-11-17-59-44;1-32-31-74-36(5)52(32)42-23-46-40(25-50(42)71-7)54-48(27-60-46)63(56(69)65(54)34(3)44-17-9-11-19-58-44)29-38(67)15-13-21-73-22-14-16-39(68)30-64-49-28-61-47-24-43(53-33(2)62-75-37(53)6)51(72-8)26-41(47)55(49)66(57(64)70)35(4)45-18-10-12-20-59-45;1-30-29-71-34(5)50(30)40-21-44-38(23-48(40)69-7)52-46(25-58-44)61(54(67)63(52)32(3)42-17-11-13-19-56-42)27-36(65)15-9-10-16-37(66)28-62-47-26-59-45-22-41(51-31(2)60-72-35(51)6)49(70-8)24-39(45)53(47)64(55(62)68)33(4)43-18-12-14-20-57-43/h9-12,17-20,27-32,35,38-39H,13-16,21-26,33-34H2,1-8H3;9-12,15-18,24-29,32,35-36H,13-14,19-23,30-31H2,1-8H3,(H,61,70);9-12,17-20,23-28,31,34-35H,13-16,21-22,29-30H2,1-8H3;11-14,17-26,29,32-33H,9-10,15-16,27-28H2,1-8H3
InChIKeyLZXJMFFIQTXCIX-UHFFFAOYSA-N
XLogP37.22
TPSA856.17 Ų
H-Bond Donors1
H-Bond Acceptors74
Rotatable Bonds85
Heavy Atoms306
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004137.64
LogP ≤ 537.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1074

Analyze 7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide?
The IUPAC name of 7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide (CID 159505325) is 7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide.
What is the SMILES notation for 7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide?
The canonical SMILES for 7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide is COc1cc2c(cc1-c1c(C)coc1C)ncc1c2n(C(C)c2ccccn2)c(=O)n1CC(=O)CCCCC(=O)Cn1c(=O)n(C(C)c2ccccn2)c2c3cc(OC)c(-c4c(C)noc4C)cc3ncc21.COc1cc2c(cc1-c1c(C)coc1C)ncc1c2n(C(C)c2ccccn2)c(=O)n1CC(=O)CCCOCCCC(=O)Cn1c(=O)n(C(C)c2ccccn2)c2c3cc(OC)c(-c4c(C)noc4C)cc3ncc21.COc1cc2c(cc1-c1c(C)coc1C)ncc1c2n(C(C)c2ccccn2)c(=O)n1CC(=O)CCCOCCOCCOCCCC(=O)Cn1c(=O)n(C(C)c2ccccn2)c2c3cc(OC)c(-c4c(C)noc4C)cc3ncc21.COc1cc2c(cc1-c1c(C)coc1C)ncc1c2n(C(C)c2ccccn2)c(=O)n1CC(=O)NCCOCCOCCCC(=O)Cn1c(=O)n(C(C)c2ccccn2)c2c3cc(OC)c(-c4c(C)noc4C)cc3ncc21.
What is the InChIKey of 7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide?
The InChIKey is LZXJMFFIQTXCIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H65N9O11.C58H60N10O10.C57H57N9O9.C55H53N9O8/c1-36-35-80-40(5)56(36)46-27-50-44(29-54(46)75-7)58-52(31-64-50)67(60(73)69(58)38(3)48-17-9-11-19-62-48)33-42(71)15-13-21-77-23-25-79-26-24-78-22-14-16-43(72)34-68-53-32-65-51-28-47(57-37(2)66-81-41(57)6)55(76-8)30-45(51)59(53)70(61(68)74)39(4)49-18-10-12-20-63-49;1-33-32-77-37(5)53(33)42-24-46-40(26-50(42)73-7)56-49(29-63-46)66(58(72)68(56)36(4)45-16-10-12-18-60-45)31-52(70)61-19-21-76-23-22-75-20-13-14-39(69)30-65-48-28-62-47-25-43(54-34(2)64-78-38(54)6)51(74-8)27-41(47)55(48)67(57(65)71)35(3)44-15-9-11-17-59-44;1-32-31-74-36(5)52(32)42-23-46-40(25-50(42)71-7)54-48(27-60-46)63(56(69)65(54)34(3)44-17-9-11-19-58-44)29-38(67)15-13-21-73-22-14-16-39(68)30-64-49-28-61-47-24-43(53-33(2)62-75-37(53)6)51(72-8)26-41(47)55(49)66(57(64)70)35(4)45-18-10-12-20-59-45;1-30-29-71-34(5)50(30)40-21-44-38(23-48(40)69-7)52-46(25-58-44)61(54(67)63(52)32(3)42-17-11-13-19-56-42)27-36(65)15-9-10-16-37(66)28-62-47-26-59-45-22-41(51-31(2)60-72-35(51)6)49(70-8)24-39(45)53(47)64(55(62)68)33(4)43-18-12-14-20-57-43/h9-12,17-20,27-32,35,38-39H,13-16,21-26,33-34H2,1-8H3;9-12,15-18,24-29,32,35-36H,13-14,19-23,30-31H2,1-8H3,(H,61,70);9-12,17-20,23-28,31,34-35H,13-16,21-22,29-30H2,1-8H3;11-14,17-26,29,32-33H,9-10,15-16,27-28H2,1-8H3.
What are the key properties of 7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide?
7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide has a molecular weight of 4137.64 g/mol, XLogP of 37.22, 85 rotatable bonds, 1 hydrogen bond donors, and 74 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2,4-dimethylfuran-3-yl)-3-[5-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;7-(2,4-dimethylfuran-3-yl)-3-[5-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]-2-oxopentyl]-8-methoxy-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-2-one;1-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]octane-2,7-dione;2-[7-(2,4-dimethylfuran-3-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-N-[2-[2-[5-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-2-oxo-1-(1-pyridin-2-ylethyl)imidazo[4,5-c]quinolin-3-yl]-4-oxopentoxy]ethoxy]ethyl]acetamide is sourced from PubChem (CID 159505325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).