lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide

C199H288Cl4LiN20O45PS7 — CID 159553034

About lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide

lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide (PubChem CID 159553034) has the molecular formula C199H288Cl4LiN20O45PS7 and a molecular weight of 4084.78 g/mol. Its IUPAC name is lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide.

Molecular Properties

• Compound Name: lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide
• PubChem CID: 159553034
• Molecular Formula: C199H288Cl4LiN20O45PS7
• Molecular Weight: 4084.78 g/mol
• Exact Mass: 4079.76
• IUPAC Name: lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide
• SMILES: CC1(C(=O)OC2CCC(N3CCOCC3)CC2)CCc2sc3ncnc(OC4CCC(N5CCOCC5)CC4)c3c2C1.CC1(C(N)=O)CCc2sc3ncnc(OC4CCC(N5CCOCC5)CC4)c3c2C1.CCOC(=O)C1(C)CCCC(=O)C1.CCOC(=O)C1(C)CCCC2(C1)OCCO2.CCOC(=O)C1(C)CCc2sc3nc[nH]c(=O)c3c2C1.CCOC(=O)C1(C)CCc2sc3ncnc(Cl)c3c2C1.CCOC(=O)C1(C)CCc2sc3ncnc(OC4CCC(N5CCOCC5)CC4)c3c2C1.CCOC(=O)C1(C)CCc2sc3ncnc(OC4CCC(N5CCOCC5)CC4)c3c2C1.CCOC(=O)C1CCCC(=O)C1.CCOC(=O)C1CCCC2(C1)OCCO2.CCOC(=O)c1c(N)sc2c1CC(C)(C(=O)OCC)CC2.O=P(Cl)(Cl)Cl.OC1CCC(N2CCOCC2)CC1.OCCO.[Li+].[OH-]
• InChI: InChI=1S/C32H46N4O5S.2C24H33N3O4S.C22H30N4O3S.C15H21NO4S.C14H15ClN2O2S.C14H16N2O3S.C12H20O4.C11H18O4.C10H19NO2.C10H16O3.C9H14O3.C2H6O2.Cl3OP.Li.H2O/c1-32(31(37)41-25-8-4-23(5-9-25)36-14-18-39-19-15-36)11-10-27-26(20-32)28-29(33-21-34-30(28)42-27)40-24-6-2-22(3-7-24)35-12-16-38-17-13-35;2*1-3-30-23(28)24(2)9-8-19-18(14-24)20-21(25-15-26-22(20)32-19)31-17-6-4-16(5-7-17)27-10-12-29-13-11-27;1-22(21(23)27)7-6-17-16(12-22)18-19(24-13-25-20(18)30-17)29-15-4-2-14(3-5-15)26-8-10-28-11-9-26;1-4-19-13(17)11-9-8-15(3,14(18)20-5-2)7-6-10(9)21-12(11)16;1-3-19-13(18)14(2)5-4-9-8(6-14)10-11(15)16-7-17-12(10)20-9;1-3-19-13(18)14(2)5-4-9-8(6-14)10-11(17)15-7-16-12(10)20-9;1-3-14-10(13)11(2)5-4-6-12(9-11)15-7-8-16-12;1-2-13-10(12)9-4-3-5-11(8-9)14-6-7-15-11;12-10-3-1-9(2-4-10)11-5-7-13-8-6-11;1-3-13-9(12)10(2)6-4-5-8(11)7-10;1-2-12-9(11)7-4-3-5-8(10)6-7;3-1-2-4;1-5(2,3)4;;/h21-25H,2-20H2,1H3;2*15-17H,3-14H2,1-2H3;13-15H,2-12H2,1H3,(H2,23,27);4-8,16H2,1-3H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3,(H,15,16,17);3-9H2,1-2H3;9H,2-8H2,1H3;9-10,12H,1-8H2;3-7H2,1-2H3;7H,2-6H2,1H3;3-4H,1-2H2;;;1H2/q;;;;;;;;;;;;;;+1;/p-1
• InChIKey: MFQGABKJYSLUKY-UHFFFAOYSA-M
• XLogP: 28.24
• TPSA: 823.62 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 70
• Rotatable Bonds: 38
• Heavy Atoms: 277
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4084.78
LogP ≤ 5	28.24
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	70

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'thiophene_amino_Aa(45)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide?

The IUPAC name of lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide (CID 159553034) is lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide.

What is the SMILES notation for lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide?

The canonical SMILES for lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide is CC1(C(=O)OC2CCC(N3CCOCC3)CC2)CCc2sc3ncnc(OC4CCC(N5CCOCC5)CC4)c3c2C1.CC1(C(N)=O)CCc2sc3ncnc(OC4CCC(N5CCOCC5)CC4)c3c2C1.CCOC(=O)C1(C)CCCC(=O)C1.CCOC(=O)C1(C)CCCC2(C1)OCCO2.CCOC(=O)C1(C)CCc2sc3nc[nH]c(=O)c3c2C1.CCOC(=O)C1(C)CCc2sc3ncnc(Cl)c3c2C1.CCOC(=O)C1(C)CCc2sc3ncnc(OC4CCC(N5CCOCC5)CC4)c3c2C1.CCOC(=O)C1(C)CCc2sc3ncnc(OC4CCC(N5CCOCC5)CC4)c3c2C1.CCOC(=O)C1CCCC(=O)C1.CCOC(=O)C1CCCC2(C1)OCCO2.CCOC(=O)c1c(N)sc2c1CC(C)(C(=O)OCC)CC2.O=P(Cl)(Cl)Cl.OC1CCC(N2CCOCC2)CC1.OCCO.[Li+].[OH-].

What is the InChIKey of lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide?

The InChIKey is MFQGABKJYSLUKY-UHFFFAOYSA-M. The full InChI is InChI=1S/C32H46N4O5S.2C24H33N3O4S.C22H30N4O3S.C15H21NO4S.C14H15ClN2O2S.C14H16N2O3S.C12H20O4.C11H18O4.C10H19NO2.C10H16O3.C9H14O3.C2H6O2.Cl3OP.Li.H2O/c1-32(31(37)41-25-8-4-23(5-9-25)36-14-18-39-19-15-36)11-10-27-26(20-32)28-29(33-21-34-30(28)42-27)40-24-6-2-22(3-7-24)35-12-16-38-17-13-35;2*1-3-30-23(28)24(2)9-8-19-18(14-24)20-21(25-15-26-22(20)32-19)31-17-6-4-16(5-7-17)27-10-12-29-13-11-27;1-22(21(23)27)7-6-17-16(12-22)18-19(24-13-25-20(18)30-17)29-15-4-2-14(3-5-15)26-8-10-28-11-9-26;1-4-19-13(17)11-9-8-15(3,14(18)20-5-2)7-6-10(9)21-12(11)16;1-3-19-13(18)14(2)5-4-9-8(6-14)10-11(15)16-7-17-12(10)20-9;1-3-19-13(18)14(2)5-4-9-8(6-14)10-11(17)15-7-16-12(10)20-9;1-3-14-10(13)11(2)5-4-6-12(9-11)15-7-8-16-12;1-2-13-10(12)9-4-3-5-11(8-9)14-6-7-15-11;12-10-3-1-9(2-4-10)11-5-7-13-8-6-11;1-3-13-9(12)10(2)6-4-5-8(11)7-10;1-2-12-9(11)7-4-3-5-8(10)6-7;3-1-2-4;1-5(2,3)4;;/h21-25H,2-20H2,1H3;2*15-17H,3-14H2,1-2H3;13-15H,2-12H2,1H3,(H2,23,27);4-8,16H2,1-3H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3,(H,15,16,17);3-9H2,1-2H3;9H,2-8H2,1H3;9-10,12H,1-8H2;3-7H2,1-2H3;7H,2-6H2,1H3;3-4H,1-2H2;;;1H2/q;;;;;;;;;;;;;;+1;/p-1.

What are the key properties of lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide?

lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide has a molecular weight of 4084.78 g/mol, XLogP of 28.24, 38 rotatable bonds, 6 hydrogen bond donors, and 70 hydrogen bond acceptors.

Where does this data come from?

All data for lithium;diethyl 2-amino-5-methyl-6,7-dihydro-4H-1-benzothiophene-3,5-dicarboxylate;ethane-1,2-diol;ethyl 4-chloro-6-methyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 1,4-dioxaspiro[4.5]decane-7-carboxylate;ethyl 7-methyl-1,4-dioxaspiro[4.5]decane-7-carboxylate;bis(ethyl 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate);ethyl 1-methyl-3-oxocyclohexane-1-carboxylate;ethyl 6-methyl-4-oxo-3,5,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;ethyl 3-oxocyclohexane-1-carboxylate;6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxamide;4-morpholin-4-ylcyclohexan-1-ol;(4-morpholin-4-ylcyclohexyl) 6-methyl-4-(4-morpholin-4-ylcyclohexyl)oxy-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-6-carboxylate;phosphoryl trichloride;hydroxide is sourced from PubChem (CID 159553034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).