5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one

C233H194N20O47S11 — CID 159406375

IUPAC5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one
SMILESCOc1cc(Oc2cccc(COc3ccc(C4=CC(=O)NS4=O)cc3)c2)ccn1.COc1ccc(Oc2cccc(COc3ccc(C4=CC(=O)NS4=O)cc3)c2)cn1.COc1cnccc1Oc1cccc2c1CCC2Oc1ccc(C2=CC(=O)NS2=O)cc1.COc1ncccc1Oc1cccc2c1CCC2Oc1ccc(C2=CC(=O)NS2=O)cc1.Cc1ccc(Oc2cccc(COc3ccc(C4=CC(=O)NS4=O)cc3)c2)cn1.Cc1ccc(Oc2cccc3c2CCC3Oc2ccc(C3=CC(=O)NS3=O)cc2)cn1.Cc1cnccc1Oc1cccc2c1CCC2Oc1ccc(C2=CC(=O)NS2=O)cc1.Cc1nc(OCCCS(C)(=O)=O)ccc1Oc1cccc(COc2ccc(C3=CC(=O)NS3=O)cc2)c1.Cc1ncccc1Oc1cccc(COc2ccc(C3=CC(=O)NS3=O)cc2)c1.[C-]#[N+]c1cccc(Oc2cccc(COc3ccc(C4=CC(=O)NS4=O)cc3)c2)c1
InChIInChI=1S/C26H26N2O7S2.2C24H20N2O5S.2C24H20N2O4S.C23H16N2O4S.2C22H18N2O5S.2C22H18N2O4S/c1-18-23(11-12-26(27-18)33-13-4-14-37(2,31)32)35-22-6-3-5-19(15-22)17-34-21-9-7-20(8-10-21)24-16-25(29)28-36(24)30;1-29-24-21(6-3-13-25-24)31-19-5-2-4-17-18(19)11-12-20(17)30-16-9-7-15(8-10-16)22-14-23(27)26-32(22)28;1-29-22-14-25-12-11-21(22)31-19-4-2-3-17-18(19)9-10-20(17)30-16-7-5-15(6-8-16)23-13-24(27)26-32(23)28;1-15-5-8-18(14-25-15)30-21-4-2-3-19-20(21)11-12-22(19)29-17-9-6-16(7-10-17)23-13-24(27)26-31(23)28;1-15-14-25-12-11-20(15)30-21-4-2-3-18-19(21)9-10-22(18)29-17-7-5-16(6-8-17)23-13-24(27)26-31(23)28;1-24-18-5-3-7-21(13-18)29-20-6-2-4-16(12-20)15-28-19-10-8-17(9-11-19)22-14-23(26)25-30(22)27;1-27-22-10-9-19(13-23-22)29-18-4-2-3-15(11-18)14-28-17-7-5-16(6-8-17)20-12-21(25)24-30(20)26;1-27-22-12-19(9-10-23-22)29-18-4-2-3-15(11-18)14-28-17-7-5-16(6-8-17)20-13-21(25)24-30(20)26;1-15-20(6-3-11-23-15)28-19-5-2-4-16(12-19)14-27-18-9-7-17(8-10-18)21-13-22(25)24-29(21)26;1-15-5-8-20(13-23-15)28-19-4-2-3-16(11-19)14-27-18-9-6-17(7-10-18)21-12-22(25)24-29(21)26/h3,5-12,15-16H,4,13-14,17H2,1-2H3,(H,28,29);2-10,13-14,20H,11-12H2,1H3,(H,26,27);2-8,11-14,20H,9-10H2,1H3,(H,26,27);2-10,13-14,22H,11-12H2,1H3,(H,26,27);2-8,11-14,22H,9-10H2,1H3,(H,26,27);2-14H,15H2,(H,25,26);2*2-13H,14H2,1H3,(H,24,25);2*2-13H,14H2,1H3,(H,24,25)
InChIKeyLNZUTBRZYRPEFN-UHFFFAOYSA-N
MW4378.94 g/mol
LogP40.37
Rot. Bonds65

About 5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one

5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one (PubChem CID 159406375) has the molecular formula C233H194N20O47S11 and a molecular weight of 4378.94 g/mol. Its IUPAC name is 5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one.

Molecular Properties

Compound Name5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one
PubChem CID159406375
Molecular FormulaC233H194N20O47S11
Molecular Weight4378.94 g/mol
Exact Mass4375.03
IUPAC Name5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one
SMILESCOc1cc(Oc2cccc(COc3ccc(C4=CC(=O)NS4=O)cc3)c2)ccn1.COc1ccc(Oc2cccc(COc3ccc(C4=CC(=O)NS4=O)cc3)c2)cn1.COc1cnccc1Oc1cccc2c1CCC2Oc1ccc(C2=CC(=O)NS2=O)cc1.COc1ncccc1Oc1cccc2c1CCC2Oc1ccc(C2=CC(=O)NS2=O)cc1.Cc1ccc(Oc2cccc(COc3ccc(C4=CC(=O)NS4=O)cc3)c2)cn1.Cc1ccc(Oc2cccc3c2CCC3Oc2ccc(C3=CC(=O)NS3=O)cc2)cn1.Cc1cnccc1Oc1cccc2c1CCC2Oc1ccc(C2=CC(=O)NS2=O)cc1.Cc1nc(OCCCS(C)(=O)=O)ccc1Oc1cccc(COc2ccc(C3=CC(=O)NS3=O)cc2)c1.Cc1ncccc1Oc1cccc(COc2ccc(C3=CC(=O)NS3=O)cc2)c1.[C-]#[N+]c1cccc(Oc2cccc(COc3ccc(C4=CC(=O)NS4=O)cc3)c2)c1
InChIInChI=1S/C26H26N2O7S2.2C24H20N2O5S.2C24H20N2O4S.C23H16N2O4S.2C22H18N2O5S.2C22H18N2O4S/c1-18-23(11-12-26(27-18)33-13-4-14-37(2,31)32)35-22-6-3-5-19(15-22)17-34-21-9-7-20(8-10-21)24-16-25(29)28-36(24)30;1-29-24-21(6-3-13-25-24)31-19-5-2-4-17-18(19)11-12-20(17)30-16-9-7-15(8-10-16)22-14-23(27)26-32(22)28;1-29-22-14-25-12-11-21(22)31-19-4-2-3-17-18(19)9-10-20(17)30-16-7-5-15(6-8-16)23-13-24(27)26-32(23)28;1-15-5-8-18(14-25-15)30-21-4-2-3-19-20(21)11-12-22(19)29-17-9-6-16(7-10-17)23-13-24(27)26-31(23)28;1-15-14-25-12-11-20(15)30-21-4-2-3-18-19(21)9-10-22(18)29-17-7-5-16(6-8-17)23-13-24(27)26-31(23)28;1-24-18-5-3-7-21(13-18)29-20-6-2-4-16(12-20)15-28-19-10-8-17(9-11-19)22-14-23(26)25-30(22)27;1-27-22-10-9-19(13-23-22)29-18-4-2-3-15(11-18)14-28-17-7-5-16(6-8-17)20-12-21(25)24-30(20)26;1-27-22-12-19(9-10-23-22)29-18-4-2-3-15(11-18)14-28-17-7-5-16(6-8-17)20-13-21(25)24-30(20)26;1-15-20(6-3-11-23-15)28-19-5-2-4-16(12-19)14-27-18-9-7-17(8-10-18)21-13-22(25)24-29(21)26;1-15-5-8-20(13-23-15)28-19-4-2-3-16(11-19)14-27-18-9-6-17(7-10-18)21-12-22(25)24-29(21)26/h3,5-12,15-16H,4,13-14,17H2,1-2H3,(H,28,29);2-10,13-14,20H,11-12H2,1H3,(H,26,27);2-8,11-14,20H,9-10H2,1H3,(H,26,27);2-10,13-14,22H,11-12H2,1H3,(H,26,27);2-8,11-14,22H,9-10H2,1H3,(H,26,27);2-14H,15H2,(H,25,26);2*2-13H,14H2,1H3,(H,24,25);2*2-13H,14H2,1H3,(H,24,25)
InChIKeyLNZUTBRZYRPEFN-UHFFFAOYSA-N
XLogP40.37
TPSA846.96 Ų
H-Bond Donors10
H-Bond Acceptors56
Rotatable Bonds65
Heavy Atoms311
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004378.94
LogP ≤ 540.37
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1056

Analyze 5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one?
The IUPAC name of 5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one (CID 159406375) is 5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one.
What is the SMILES notation for 5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one?
The canonical SMILES for 5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one is COc1cc(Oc2cccc(COc3ccc(C4=CC(=O)NS4=O)cc3)c2)ccn1.COc1ccc(Oc2cccc(COc3ccc(C4=CC(=O)NS4=O)cc3)c2)cn1.COc1cnccc1Oc1cccc2c1CCC2Oc1ccc(C2=CC(=O)NS2=O)cc1.COc1ncccc1Oc1cccc2c1CCC2Oc1ccc(C2=CC(=O)NS2=O)cc1.Cc1ccc(Oc2cccc(COc3ccc(C4=CC(=O)NS4=O)cc3)c2)cn1.Cc1ccc(Oc2cccc3c2CCC3Oc2ccc(C3=CC(=O)NS3=O)cc2)cn1.Cc1cnccc1Oc1cccc2c1CCC2Oc1ccc(C2=CC(=O)NS2=O)cc1.Cc1nc(OCCCS(C)(=O)=O)ccc1Oc1cccc(COc2ccc(C3=CC(=O)NS3=O)cc2)c1.Cc1ncccc1Oc1cccc(COc2ccc(C3=CC(=O)NS3=O)cc2)c1.[C-]#[N+]c1cccc(Oc2cccc(COc3ccc(C4=CC(=O)NS4=O)cc3)c2)c1.
What is the InChIKey of 5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one?
The InChIKey is LNZUTBRZYRPEFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N2O7S2.2C24H20N2O5S.2C24H20N2O4S.C23H16N2O4S.2C22H18N2O5S.2C22H18N2O4S/c1-18-23(11-12-26(27-18)33-13-4-14-37(2,31)32)35-22-6-3-5-19(15-22)17-34-21-9-7-20(8-10-21)24-16-25(29)28-36(24)30;1-29-24-21(6-3-13-25-24)31-19-5-2-4-17-18(19)11-12-20(17)30-16-9-7-15(8-10-16)22-14-23(27)26-32(22)28;1-29-22-14-25-12-11-21(22)31-19-4-2-3-17-18(19)9-10-20(17)30-16-7-5-15(6-8-16)23-13-24(27)26-32(23)28;1-15-5-8-18(14-25-15)30-21-4-2-3-19-20(21)11-12-22(19)29-17-9-6-16(7-10-17)23-13-24(27)26-31(23)28;1-15-14-25-12-11-20(15)30-21-4-2-3-18-19(21)9-10-22(18)29-17-7-5-16(6-8-17)23-13-24(27)26-31(23)28;1-24-18-5-3-7-21(13-18)29-20-6-2-4-16(12-20)15-28-19-10-8-17(9-11-19)22-14-23(26)25-30(22)27;1-27-22-10-9-19(13-23-22)29-18-4-2-3-15(11-18)14-28-17-7-5-16(6-8-17)20-12-21(25)24-30(20)26;1-27-22-12-19(9-10-23-22)29-18-4-2-3-15(11-18)14-28-17-7-5-16(6-8-17)20-13-21(25)24-30(20)26;1-15-20(6-3-11-23-15)28-19-5-2-4-16(12-19)14-27-18-9-7-17(8-10-18)21-13-22(25)24-29(21)26;1-15-5-8-20(13-23-15)28-19-4-2-3-16(11-19)14-27-18-9-6-17(7-10-18)21-12-22(25)24-29(21)26/h3,5-12,15-16H,4,13-14,17H2,1-2H3,(H,28,29);2-10,13-14,20H,11-12H2,1H3,(H,26,27);2-8,11-14,20H,9-10H2,1H3,(H,26,27);2-10,13-14,22H,11-12H2,1H3,(H,26,27);2-8,11-14,22H,9-10H2,1H3,(H,26,27);2-14H,15H2,(H,25,26);2*2-13H,14H2,1H3,(H,24,25);2*2-13H,14H2,1H3,(H,24,25).
What are the key properties of 5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one?
5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one has a molecular weight of 4378.94 g/mol, XLogP of 40.37, 65 rotatable bonds, 10 hydrogen bond donors, and 56 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[[3-(3-isocyanophenoxy)phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(2-methoxy-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methoxy-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methoxy-4-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methoxy-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[[2-methyl-6-(3-methylsulfonylpropoxy)-3-pyridinyl]oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(3-methyl-4-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[4-[(6-methyl-3-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(2-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one;5-[4-[[3-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]phenyl]-1-oxo-1,2-thiazol-3-one is sourced from PubChem (CID 159406375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).