3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid

C164H174F18N20O36 — CID 167584272

IUPAC3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid
SMILESCCCCCC(Oc1ccc(C(=O)O)c(C(=O)O)c1)C(F)(F)F.CCCCCC(Oc1ccc(C(=O)OC)c(C(=O)OC)c1)C(F)(F)F.CCCCCC(Oc1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O)C(F)(F)F.Cn1c2ccncc2c2ccc(-c3ccc(N4CC(OC5CCN(CCCCC(Oc6ccc7c(c6)C(=O)N(C6CCC(=O)NC6=O)C7=O)C(F)(F)F)CC5)C4)nc3)cc21.Cn1c2ccncc2c2ccc(-c3ccc(N4CC(OC5CCNCC5)C4)nc3)cc21.NC1CCC(=O)NC1=O.O=C1CCC(N2C(=O)c3ccc(OC(CCCCO)C(F)(F)F)cc3C2=O)C(=O)N1.O=CCCCC(Oc1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O)C(F)(F)F
InChIInChI=1S/C44H44F3N7O6.C25H27N5O.C20H21F3N2O5.C19H19F3N2O6.C19H17F3N2O6.C17H21F3O5.C15H17F3O5.C5H8N2O2/c1-51-35-13-16-48-23-34(35)31-8-5-26(20-37(31)51)27-6-11-39(49-22-27)53-24-30(25-53)59-28-14-18-52(19-15-28)17-3-2-4-38(44(45,46)47)60-29-7-9-32-33(21-29)43(58)54(42(32)57)36-10-12-40(55)50-41(36)56;1-29-23-8-11-27-14-22(23)21-4-2-17(12-24(21)29)18-3-5-25(28-13-18)30-15-20(16-30)31-19-6-9-26-10-7-19;1-2-3-4-5-15(20(21,22)23)30-11-6-7-12-13(10-11)19(29)25(18(12)28)14-8-9-16(26)24-17(14)27;2*20-19(21,22)14(3-1-2-8-25)30-10-4-5-11-12(9-10)18(29)24(17(11)28)13-6-7-15(26)23-16(13)27;1-4-5-6-7-14(17(18,19)20)25-11-8-9-12(15(21)23-2)13(10-11)16(22)24-3;1-2-3-4-5-12(15(16,17)18)23-9-6-7-10(13(19)20)11(8-9)14(21)22;6-3-1-2-4(8)7-5(3)9/h5-9,11,13,16,20-23,28,30,36,38H,2-4,10,12,14-15,17-19,24-25H2,1H3,(H,50,55,56);2-5,8,11-14,19-20,26H,6-7,9-10,15-16H2,1H3;6-7,10,14-15H,2-5,8-9H2,1H3,(H,24,26,27);4-5,9,13-14,25H,1-3,6-8H2,(H,23,26,27);4-5,8-9,13-14H,1-3,6-7H2,(H,23,26,27);8-10,14H,4-7H2,1-3H3;6-8,12H,2-5H2,1H3,(H,19,20)(H,21,22);3H,1-2,6H2,(H,7,8,9)
InChIKeyHOSQJAFEVKILSL-UHFFFAOYSA-N
MW3343.26 g/mol
LogP22.96
Rot. Bonds53

About 3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid

3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid (PubChem CID 167584272) has the molecular formula C164H174F18N20O36 and a molecular weight of 3343.26 g/mol. Its IUPAC name is 3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid.

Molecular Properties

Compound Name3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid
PubChem CID167584272
Molecular FormulaC164H174F18N20O36
Molecular Weight3343.26 g/mol
Exact Mass3341.21
IUPAC Name3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid
SMILESCCCCCC(Oc1ccc(C(=O)O)c(C(=O)O)c1)C(F)(F)F.CCCCCC(Oc1ccc(C(=O)OC)c(C(=O)OC)c1)C(F)(F)F.CCCCCC(Oc1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O)C(F)(F)F.Cn1c2ccncc2c2ccc(-c3ccc(N4CC(OC5CCN(CCCCC(Oc6ccc7c(c6)C(=O)N(C6CCC(=O)NC6=O)C7=O)C(F)(F)F)CC5)C4)nc3)cc21.Cn1c2ccncc2c2ccc(-c3ccc(N4CC(OC5CCNCC5)C4)nc3)cc21.NC1CCC(=O)NC1=O.O=C1CCC(N2C(=O)c3ccc(OC(CCCCO)C(F)(F)F)cc3C2=O)C(=O)N1.O=CCCCC(Oc1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O)C(F)(F)F
InChIInChI=1S/C44H44F3N7O6.C25H27N5O.C20H21F3N2O5.C19H19F3N2O6.C19H17F3N2O6.C17H21F3O5.C15H17F3O5.C5H8N2O2/c1-51-35-13-16-48-23-34(35)31-8-5-26(20-37(31)51)27-6-11-39(49-22-27)53-24-30(25-53)59-28-14-18-52(19-15-28)17-3-2-4-38(44(45,46)47)60-29-7-9-32-33(21-29)43(58)54(42(32)57)36-10-12-40(55)50-41(36)56;1-29-23-8-11-27-14-22(23)21-4-2-17(12-24(21)29)18-3-5-25(28-13-18)30-15-20(16-30)31-19-6-9-26-10-7-19;1-2-3-4-5-15(20(21,22)23)30-11-6-7-12-13(10-11)19(29)25(18(12)28)14-8-9-16(26)24-17(14)27;2*20-19(21,22)14(3-1-2-8-25)30-10-4-5-11-12(9-10)18(29)24(17(11)28)13-6-7-15(26)23-16(13)27;1-4-5-6-7-14(17(18,19)20)25-11-8-9-12(15(21)23-2)13(10-11)16(22)24-3;1-2-3-4-5-12(15(16,17)18)23-9-6-7-10(13(19)20)11(8-9)14(21)22;6-3-1-2-4(8)7-5(3)9/h5-9,11,13,16,20-23,28,30,36,38H,2-4,10,12,14-15,17-19,24-25H2,1H3,(H,50,55,56);2-5,8,11-14,19-20,26H,6-7,9-10,15-16H2,1H3;6-7,10,14-15H,2-5,8-9H2,1H3,(H,24,26,27);4-5,9,13-14,25H,1-3,6-8H2,(H,23,26,27);4-5,8-9,13-14H,1-3,6-7H2,(H,23,26,27);8-10,14H,4-7H2,1-3H3;6-8,12H,2-5H2,1H3,(H,19,20)(H,21,22);3H,1-2,6H2,(H,7,8,9)
InChIKeyHOSQJAFEVKILSL-UHFFFAOYSA-N
XLogP22.96
TPSA727.90 Ų
H-Bond Donors10
H-Bond Acceptors45
Rotatable Bonds53
Heavy Atoms238
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003343.26
LogP ≤ 522.96
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1045

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid?
The IUPAC name of 3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid (CID 167584272) is 3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid.
What is the SMILES notation for 3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid?
The canonical SMILES for 3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid is CCCCCC(Oc1ccc(C(=O)O)c(C(=O)O)c1)C(F)(F)F.CCCCCC(Oc1ccc(C(=O)OC)c(C(=O)OC)c1)C(F)(F)F.CCCCCC(Oc1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O)C(F)(F)F.Cn1c2ccncc2c2ccc(-c3ccc(N4CC(OC5CCN(CCCCC(Oc6ccc7c(c6)C(=O)N(C6CCC(=O)NC6=O)C7=O)C(F)(F)F)CC5)C4)nc3)cc21.Cn1c2ccncc2c2ccc(-c3ccc(N4CC(OC5CCNCC5)C4)nc3)cc21.NC1CCC(=O)NC1=O.O=C1CCC(N2C(=O)c3ccc(OC(CCCCO)C(F)(F)F)cc3C2=O)C(=O)N1.O=CCCCC(Oc1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O)C(F)(F)F.
What is the InChIKey of 3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid?
The InChIKey is HOSQJAFEVKILSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H44F3N7O6.C25H27N5O.C20H21F3N2O5.C19H19F3N2O6.C19H17F3N2O6.C17H21F3O5.C15H17F3O5.C5H8N2O2/c1-51-35-13-16-48-23-34(35)31-8-5-26(20-37(31)51)27-6-11-39(49-22-27)53-24-30(25-53)59-28-14-18-52(19-15-28)17-3-2-4-38(44(45,46)47)60-29-7-9-32-33(21-29)43(58)54(42(32)57)36-10-12-40(55)50-41(36)56;1-29-23-8-11-27-14-22(23)21-4-2-17(12-24(21)29)18-3-5-25(28-13-18)30-15-20(16-30)31-19-6-9-26-10-7-19;1-2-3-4-5-15(20(21,22)23)30-11-6-7-12-13(10-11)19(29)25(18(12)28)14-8-9-16(26)24-17(14)27;2*20-19(21,22)14(3-1-2-8-25)30-10-4-5-11-12(9-10)18(29)24(17(11)28)13-6-7-15(26)23-16(13)27;1-4-5-6-7-14(17(18,19)20)25-11-8-9-12(15(21)23-2)13(10-11)16(22)24-3;1-2-3-4-5-12(15(16,17)18)23-9-6-7-10(13(19)20)11(8-9)14(21)22;6-3-1-2-4(8)7-5(3)9/h5-9,11,13,16,20-23,28,30,36,38H,2-4,10,12,14-15,17-19,24-25H2,1H3,(H,50,55,56);2-5,8,11-14,19-20,26H,6-7,9-10,15-16H2,1H3;6-7,10,14-15H,2-5,8-9H2,1H3,(H,24,26,27);4-5,9,13-14,25H,1-3,6-8H2,(H,23,26,27);4-5,8-9,13-14H,1-3,6-7H2,(H,23,26,27);8-10,14H,4-7H2,1-3H3;6-8,12H,2-5H2,1H3,(H,19,20)(H,21,22);3H,1-2,6H2,(H,7,8,9).
What are the key properties of 3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid?
3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid has a molecular weight of 3343.26 g/mol, XLogP of 22.96, 53 rotatable bonds, 10 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 3-aminopiperidine-2,6-dione;dimethyl 4-(1,1,1-trifluoroheptan-2-yloxy)benzene-1,2-dicarboxylate;5-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxy-6,6,6-trifluorohexanal;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoroheptan-2-yloxy)isoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-(1,1,1-trifluoro-6-hydroxyhexan-2-yl)oxyisoindole-1,3-dione;2-(2,6-dioxopiperidin-3-yl)-5-[1,1,1-trifluoro-6-[4-[1-[5-(5-methylpyrido[4,3-b]indol-7-yl)-2-pyridinyl]azetidin-3-yl]oxypiperidin-1-yl]hexan-2-yl]oxyisoindole-1,3-dione;5-methyl-7-[6-(3-piperidin-4-yloxyazetidin-1-yl)-3-pyridinyl]pyrido[4,3-b]indole;4-(1,1,1-trifluoroheptan-2-yloxy)phthalic acid is sourced from PubChem (CID 167584272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).