(3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione

C139H161F5N18O22 — CID 161430648

IUPAC(3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione
SMILESCC1CN(Cc2ccc(F)c(CNc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)c2)CC(C)O1.CC1CN(Cc2ccc(F)c(CNc3cccc4c3CN([C@@H]3CCC(=O)NC3=O)C4=O)c2)CC(C)O1.CC1CN(Cc2ccc(F)c(CNc3cccc4c3CN([C@H]3CCC(=O)NC3=O)C4=O)c2)CC(C)O1.[2H]C([2H])(Oc1cccc2c1C([2H])([2H])N(C1([2H])C(=O)NC(=O)C([2H])([2H])C1([2H])[2H])C2=O)c1cccc(C([2H])([2H])N2C([2H])([2H])C(C)(C)OC(C)(C([2H])([2H])[2H])C2([2H])[2H])c1F.[2H]C([2H])(Oc1cccc2c1C([2H])([2H])N(C1C(=O)NC(=O)C([2H])([2H])C1([2H])[2H])C2=O)c1cccc(C([2H])([2H])N2C([2H])([2H])C(C)(C)OC(C)(C([2H])([2H])[2H])C2([2H])[2H])c1F
InChIInChI=1S/2C29H34FN3O5.3C27H31FN4O4/c2*1-28(2)16-32(17-29(3,4)38-28)13-18-7-5-8-19(25(18)30)15-37-23-10-6-9-20-21(23)14-33(27(20)36)22-11-12-24(34)31-26(22)35;3*1-16-12-31(13-17(2)36-16)14-18-6-7-22(28)19(10-18)11-29-23-5-3-4-20-21(23)15-32(27(20)35)24-8-9-25(33)30-26(24)34/h2*5-10,22H,11-17H2,1-4H3,(H,31,34,35);3*3-7,10,16-17,24,29H,8-9,11-15H2,1-2H3,(H,30,33,34)/t;;2*16?,17?,24-;/m..10./s1/i1D3,11D2,12D2,13D2,14D2,15D2,16D2,17D2,22D;1D3,11D2,12D2,13D2,14D2,15D2,16D2,17D2;;;
InChIKeyVXYQHOQNWQMTQV-KXSYPLQESA-N
MW2566.12 g/mol
LogP15.53
Rot. Bonds32

About (3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione

(3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione (PubChem CID 161430648) has the molecular formula C139H161F5N18O22 and a molecular weight of 2566.12 g/mol. Its IUPAC name is (3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione.

Molecular Properties

Compound Name(3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione
PubChem CID161430648
Molecular FormulaC139H161F5N18O22
Molecular Weight2566.12 g/mol
Exact Mass2564.41
IUPAC Name(3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione
SMILESCC1CN(Cc2ccc(F)c(CNc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)c2)CC(C)O1.CC1CN(Cc2ccc(F)c(CNc3cccc4c3CN([C@@H]3CCC(=O)NC3=O)C4=O)c2)CC(C)O1.CC1CN(Cc2ccc(F)c(CNc3cccc4c3CN([C@H]3CCC(=O)NC3=O)C4=O)c2)CC(C)O1.[2H]C([2H])(Oc1cccc2c1C([2H])([2H])N(C1([2H])C(=O)NC(=O)C([2H])([2H])C1([2H])[2H])C2=O)c1cccc(C([2H])([2H])N2C([2H])([2H])C(C)(C)OC(C)(C([2H])([2H])[2H])C2([2H])[2H])c1F.[2H]C([2H])(Oc1cccc2c1C([2H])([2H])N(C1C(=O)NC(=O)C([2H])([2H])C1([2H])[2H])C2=O)c1cccc(C([2H])([2H])N2C([2H])([2H])C(C)(C)OC(C)(C([2H])([2H])[2H])C2([2H])[2H])c1F
InChIInChI=1S/2C29H34FN3O5.3C27H31FN4O4/c2*1-28(2)16-32(17-29(3,4)38-28)13-18-7-5-8-19(25(18)30)15-37-23-10-6-9-20-21(23)14-33(27(20)36)22-11-12-24(34)31-26(22)35;3*1-16-12-31(13-17(2)36-16)14-18-6-7-22(28)19(10-18)11-29-23-5-3-4-20-21(23)15-32(27(20)35)24-8-9-25(33)30-26(24)34/h2*5-10,22H,11-17H2,1-4H3,(H,31,34,35);3*3-7,10,16-17,24,29H,8-9,11-15H2,1-2H3,(H,30,33,34)/t;;2*16?,17?,24-;/m..10./s1/i1D3,11D2,12D2,13D2,14D2,15D2,16D2,17D2,22D;1D3,11D2,12D2,13D2,14D2,15D2,16D2,17D2;;;
InChIKeyVXYQHOQNWQMTQV-KXSYPLQESA-N
XLogP15.53
TPSA449.30 Ų
H-Bond Donors8
H-Bond Acceptors30
Rotatable Bonds32
Heavy Atoms184
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002566.12
LogP ≤ 515.53
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1030

Analyze (3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione with MolForge

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione?
The IUPAC name of (3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione (CID 161430648) is (3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione.
What is the SMILES notation for (3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione?
The canonical SMILES for (3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione is CC1CN(Cc2ccc(F)c(CNc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)c2)CC(C)O1.CC1CN(Cc2ccc(F)c(CNc3cccc4c3CN([C@@H]3CCC(=O)NC3=O)C4=O)c2)CC(C)O1.CC1CN(Cc2ccc(F)c(CNc3cccc4c3CN([C@H]3CCC(=O)NC3=O)C4=O)c2)CC(C)O1.[2H]C([2H])(Oc1cccc2c1C([2H])([2H])N(C1([2H])C(=O)NC(=O)C([2H])([2H])C1([2H])[2H])C2=O)c1cccc(C([2H])([2H])N2C([2H])([2H])C(C)(C)OC(C)(C([2H])([2H])[2H])C2([2H])[2H])c1F.[2H]C([2H])(Oc1cccc2c1C([2H])([2H])N(C1C(=O)NC(=O)C([2H])([2H])C1([2H])[2H])C2=O)c1cccc(C([2H])([2H])N2C([2H])([2H])C(C)(C)OC(C)(C([2H])([2H])[2H])C2([2H])[2H])c1F.
What is the InChIKey of (3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione?
The InChIKey is VXYQHOQNWQMTQV-KXSYPLQESA-N. The full InChI is InChI=1S/2C29H34FN3O5.3C27H31FN4O4/c2*1-28(2)16-32(17-29(3,4)38-28)13-18-7-5-8-19(25(18)30)15-37-23-10-6-9-20-21(23)14-33(27(20)36)22-11-12-24(34)31-26(22)35;3*1-16-12-31(13-17(2)36-16)14-18-6-7-22(28)19(10-18)11-29-23-5-3-4-20-21(23)15-32(27(20)35)24-8-9-25(33)30-26(24)34/h2*5-10,22H,11-17H2,1-4H3,(H,31,34,35);3*3-7,10,16-17,24,29H,8-9,11-15H2,1-2H3,(H,30,33,34)/t;;2*16?,17?,24-;/m..10./s1/i1D3,11D2,12D2,13D2,14D2,15D2,16D2,17D2,22D;1D3,11D2,12D2,13D2,14D2,15D2,16D2,17D2;;;.
What are the key properties of (3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione?
(3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione has a molecular weight of 2566.12 g/mol, XLogP of 15.53, 32 rotatable bonds, 8 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;(3S)-3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[5-[(2,6-dimethylmorpholin-4-yl)methyl]-2-fluorophenyl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3,3,4,4,5-pentadeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione;3,3,4,4-tetradeuterio-5-[1,1-dideuterio-7-[dideuterio-[3-[dideuterio-[3,3,5,5-tetradeuterio-2,2,6-trimethyl-6-(trideuteriomethyl)morpholin-4-yl]methyl]-2-fluorophenyl]methoxy]-3-oxoisoindol-2-yl]piperidine-2,6-dione is sourced from PubChem (CID 161430648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).