C234H303Br2N25O22W84+2 — CID 158995626
2-[1-[11-[3-(2-amino-2-oxo-1,1-diphenylethyl)pyrrolidin-1-yl]undecyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;1,11-dibromoundecane;2-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;2-[2-[11-[2-(1,3-dioxoisoindol-2-yl)ethyl-methylamino]undecyl-methylamino]ethyl]isoindole-1,3-dione;2-[1-[11-[2-(1,3-dioxoisoindol-2-yl)ethyl-methylamino]undecyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;3-(1,3-dioxoisoindol-2-yl)propyl-[6-[3-(1,3-dioxoisoindol-2-yl)propyl-dimethylazaniumyl]hexyl]-dimethylazanium;2,2-diphenyl-2-pyrrolidin-3-ylacetamide;ethyl 1,3-dioxoisoindole-2-carboxylate;2-[2-(methylamino)ethyl]isoindole-1,3-dione;N'-methylethane-1,2-diamine;tungsten (PubChem CID 158995626) has the molecular formula C234H303Br2N25O22W84+2 and a molecular weight of 19420.52 g/mol. Its IUPAC name is 2-[1-[11-[3-(2-amino-2-oxo-1,1-diphenylethyl)pyrrolidin-1-yl]undecyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;1,11-dibromoundecane;2-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;2-[2-[11-[2-(1,3-dioxoisoindol-2-yl)ethyl-methylamino]undecyl-methylamino]ethyl]isoindole-1,3-dione;2-[1-[11-[2-(1,3-dioxoisoindol-2-yl)ethyl-methylamino]undecyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;3-(1,3-dioxoisoindol-2-yl)propyl-[6-[3-(1,3-dioxoisoindol-2-yl)propyl-dimethylazaniumyl]hexyl]-dimethylazanium;2,2-diphenyl-2-pyrrolidin-3-ylacetamide;ethyl 1,3-dioxoisoindole-2-carboxylate;2-[2-(methylamino)ethyl]isoindole-1,3-dione;N'-methylethane-1,2-diamine;tungsten.
| Compound Name | 2-[1-[11-[3-(2-amino-2-oxo-1,1-diphenylethyl)pyrrolidin-1-yl]undecyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;1,11-dibromoundecane;2-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;2-[2-[11-[2-(1,3-dioxoisoindol-2-yl)ethyl-methylamino]undecyl-methylamino]ethyl]isoindole-1,3-dione;2-[1-[11-[2-(1,3-dioxoisoindol-2-yl)ethyl-methylamino]undecyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;3-(1,3-dioxoisoindol-2-yl)propyl-[6-[3-(1,3-dioxoisoindol-2-yl)propyl-dimethylazaniumyl]hexyl]-dimethylazanium;2,2-diphenyl-2-pyrrolidin-3-ylacetamide;ethyl 1,3-dioxoisoindole-2-carboxylate;2-[2-(methylamino)ethyl]isoindole-1,3-dione;N'-methylethane-1,2-diamine;tungsten |
|---|---|
| PubChem CID | 158995626 |
| Molecular Formula | C234H303Br2N25O22W84+2 |
| Molecular Weight | 19420.52 g/mol |
| Exact Mass | 19425.05 |
| IUPAC Name | 2-[1-[11-[3-(2-amino-2-oxo-1,1-diphenylethyl)pyrrolidin-1-yl]undecyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;1,11-dibromoundecane;2-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;2-[2-[11-[2-(1,3-dioxoisoindol-2-yl)ethyl-methylamino]undecyl-methylamino]ethyl]isoindole-1,3-dione;2-[1-[11-[2-(1,3-dioxoisoindol-2-yl)ethyl-methylamino]undecyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;3-(1,3-dioxoisoindol-2-yl)propyl-[6-[3-(1,3-dioxoisoindol-2-yl)propyl-dimethylazaniumyl]hexyl]-dimethylazanium;2,2-diphenyl-2-pyrrolidin-3-ylacetamide;ethyl 1,3-dioxoisoindole-2-carboxylate;2-[2-(methylamino)ethyl]isoindole-1,3-dione;N'-methylethane-1,2-diamine;tungsten |
| SMILES | BrCCCCCCCCCCCBr.CCOC(=O)N1C(=O)c2ccccc2C1=O.CN(CCCCCCCCCCCN(C)CCN1C(=O)c2ccccc2C1=O)CCN1C(=O)c2ccccc2C1=O.CN(CCCCCCCCCCCN1CCC(C(C(N)=O)(c2ccccc2)c2ccccc2)C1)CCN1C(=O)c2ccccc2C1=O.CNCCN.CNCCN1C(=O)c2ccccc2C1=O.C[N+](C)(CCCCCC[N+](C)(C)CCCN1C(=O)c2ccccc2C1=O)CCCN1C(=O)c2ccccc2C1=O.NC(=O)C(c1ccccc1)(c1ccccc1)C1CCN(CCCCCCCCCCCN2CCC(C(C(N)=O)(c3ccccc3)c3ccccc3)C2)C1.NC(=O)C(c1ccccc1)(c1ccccc1)C1CCN(CCc2ccc3c(c2)CCO3)C1.NC(=O)C(c1ccccc1)(c1ccccc1)C1CCNC1.[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W] |
| InChI | InChI=1S/C47H60N4O2.C40H52N4O3.C33H44N4O4.C32H44N4O4.C28H30N2O2.C18H20N2O.C11H22Br2.C11H12N2O2.C11H9NO4.C3H10N2.84W/c48-44(52)46(38-22-12-8-13-23-38,39-24-14-9-15-25-39)42-30-34-50(36-42)32-20-6-4-2-1-3-5-7-21-33-51-35-31-43(37-51)47(45(49)53,40-26-16-10-17-27-40)41-28-18-11-19-29-41;1-42(29-30-44-37(45)35-23-15-16-24-36(35)38(44)46)26-17-7-5-3-2-4-6-8-18-27-43-28-25-34(31-43)40(39(41)47,32-19-11-9-12-20-32)33-21-13-10-14-22-33;1-34(22-24-36-30(38)26-16-10-11-17-27(26)31(36)39)20-14-8-6-4-3-5-7-9-15-21-35(2)23-25-37-32(40)28-18-12-13-19-29(28)33(37)41;1-35(2,23-13-19-33-29(37)25-15-7-8-16-26(25)30(33)38)21-11-5-6-12-22-36(3,4)24-14-20-34-31(39)27-17-9-10-18-28(27)32(34)40;29-27(31)28(23-7-3-1-4-8-23,24-9-5-2-6-10-24)25-14-17-30(20-25)16-13-21-11-12-26-22(19-21)15-18-32-26;19-17(21)18(16-11-12-20-13-16,14-7-3-1-4-8-14)15-9-5-2-6-10-15;12-10-8-6-4-2-1-3-5-7-9-11-13;1-12-6-7-13-10(14)8-4-2-3-5-9(8)11(13)15;1-2-16-11(15)12-9(13)7-5-3-4-6-8(7)10(12)14;1-5-3-2-4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h8-19,22-29,42-43H,1-7,20-21,30-37H2,(H2,48,52)(H2,49,53);9-16,19-24,34H,2-8,17-18,25-31H2,1H3,(H2,41,47);10-13,16-19H,3-9,14-15,20-25H2,1-2H3;7-10,15-18H,5-6,11-14,19-24H2,1-4H3;1-12,19,25H,13-18,20H2,(H2,29,31);1-10,16,20H,11-13H2,(H2,19,21);1-11H2;2-5,12H,6-7H2,1H3;3-6H,2H2,1H3;5H,2-4H2,1H3;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;; |
| InChIKey | JQRYUIVTYFGXLM-UHFFFAOYSA-N |
| XLogP | 35.84 |
| TPSA | 597.43 Ų |
| H-Bond Donors | 9 |
| H-Bond Acceptors | 33 |
| Rotatable Bonds | 99 |
| Heavy Atoms | 367 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 19420.52 |
| LogP ≤ 5 | 35.84 |
| H-Bond Donors ≤ 5 | 9 |
| H-Bond Acceptors ≤ 10 | 33 |