(2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate

C92H101N17O26 — CID 176526448

IUPAC(2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate
SMILESCC(=O)O[C@@H](C(=O)O)[C@H]1OCCN(c2cccc(C(=O)N(C)CC(=O)N3CCCC3)c2)C1=O.O=C=O.O=C=O.[C-]#[N+]c1ccc(N)cc1C.[C-]#[N+]c1ccc(NC(=O)[C@H](OC(C)=O)[C@H]2OCCN(c3cccc(C(=O)N(C)CC(=O)N4CCCC4)c3)C2=O)cc1C.[H]/N=C1\N=C(N)c2ccc(NC(=O)[C@H](OC(C)=O)[C@H]3OCCN(c4cccc(C(=O)N(C)CC(=O)N5CCCC5)c4)C3=O)cc21
InChIInChI=1S/C30H33N7O7.C30H33N5O7.C22H27N3O8.C8H8N2.2CO2/c1-17(38)44-24(28(40)33-19-8-9-21-22(15-19)27(32)34-26(21)31)25-30(42)37(12-13-43-25)20-7-5-6-18(14-20)29(41)35(2)16-23(39)36-10-3-4-11-36;1-19-16-22(10-11-24(19)31-3)32-28(38)26(42-20(2)36)27-30(40)35(14-15-41-27)23-9-7-8-21(17-23)29(39)33(4)18-25(37)34-12-5-6-13-34;1-14(26)33-19(22(30)31)18-21(29)25(10-11-32-18)16-7-5-6-15(12-16)20(28)23(2)13-17(27)24-8-3-4-9-24;1-6-5-7(9)3-4-8(6)10-2;2*2-1-3/h5-9,14-15,24-25H,3-4,10-13,16H2,1-2H3,(H,33,40)(H3,31,32,34);7-11,16-17,26-27H,5-6,12-15,18H2,1-2,4H3,(H,32,38);5-7,12,18-19H,3-4,8-11,13H2,1-2H3,(H,30,31);3-5H,9H2,1H3;;/t24-,25-;26-,27-;18-,19-;;;/m111.../s1
InChIKeyJWGIBNZJYRKUKT-YZSRBQKFSA-N
MW1860.91 g/mol
LogP4.36
Rot. Bonds23

About (2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate

(2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate (PubChem CID 176526448) has the molecular formula C92H101N17O26 and a molecular weight of 1860.91 g/mol. Its IUPAC name is (2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate.

Molecular Properties

Compound Name(2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate
PubChem CID176526448
Molecular FormulaC92H101N17O26
Molecular Weight1860.91 g/mol
Exact Mass1859.71
IUPAC Name(2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate
SMILESCC(=O)O[C@@H](C(=O)O)[C@H]1OCCN(c2cccc(C(=O)N(C)CC(=O)N3CCCC3)c2)C1=O.O=C=O.O=C=O.[C-]#[N+]c1ccc(N)cc1C.[C-]#[N+]c1ccc(NC(=O)[C@H](OC(C)=O)[C@H]2OCCN(c3cccc(C(=O)N(C)CC(=O)N4CCCC4)c3)C2=O)cc1C.[H]/N=C1\N=C(N)c2ccc(NC(=O)[C@H](OC(C)=O)[C@H]3OCCN(c4cccc(C(=O)N(C)CC(=O)N5CCCC5)c4)C3=O)cc21
InChIInChI=1S/C30H33N7O7.C30H33N5O7.C22H27N3O8.C8H8N2.2CO2/c1-17(38)44-24(28(40)33-19-8-9-21-22(15-19)27(32)34-26(21)31)25-30(42)37(12-13-43-25)20-7-5-6-18(14-20)29(41)35(2)16-23(39)36-10-3-4-11-36;1-19-16-22(10-11-24(19)31-3)32-28(38)26(42-20(2)36)27-30(40)35(14-15-41-27)23-9-7-8-21(17-23)29(39)33(4)18-25(37)34-12-5-6-13-34;1-14(26)33-19(22(30)31)18-21(29)25(10-11-32-18)16-7-5-6-15(12-16)20(28)23(2)13-17(27)24-8-3-4-9-24;1-6-5-7(9)3-4-8(6)10-2;2*2-1-3/h5-9,14-15,24-25H,3-4,10-13,16H2,1-2H3,(H,33,40)(H3,31,32,34);7-11,16-17,26-27H,5-6,12-15,18H2,1-2,4H3,(H,32,38);5-7,12,18-19H,3-4,8-11,13H2,1-2H3,(H,30,31);3-5H,9H2,1H3;;/t24-,25-;26-,27-;18-,19-;;;/m111.../s1
InChIKeyJWGIBNZJYRKUKT-YZSRBQKFSA-N
XLogP4.36
TPSA550.13 Ų
H-Bond Donors6
H-Bond Acceptors28
Rotatable Bonds23
Heavy Atoms135
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001860.91
LogP ≤ 54.36
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze (2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate with MolForge

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Launch Full Analysis

Related Compounds

[2-[(1-amino-3-oxoisoindol-5-yl)amino]-1-[4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate
CID 77249217
2-[[3-[(2R)-2-[(1R)-2-[(1-amino-3-oxoisoindol-5-yl)amino]-1-hydroxy-2-oxoethyl]-3-oxomorpholin-4-yl]benzoyl]-methylamino]acetic acid
CID 58290605
(2R)-2-acetyloxy-2-[(2R)-3-oxo-4-[3-(3-oxomorpholin-4-yl)phenyl]morpholin-2-yl]acetic acid;(2R)-N-(1-amino-3H-isoindol-5-yl)-2-hydroxy-2-[(2R)-3-oxo-4-[3-(3-oxomorpholin-4-yl)phenyl]morpholin-2-yl]acetamide;[(1R)-2-[3-[[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-4-isocyanoanilino]-2-oxo-1-[(2R)-3-oxo-4-[3-(3-oxomorpholin-4-yl)phenyl]morpholin-2-yl]ethyl] acetate;tert-butyl N-[(5-amino-2-isocyanophenyl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[5-[[(2R)-2-hydroxy-2-[(2R)-3-oxo-4-[3-(3-oxomorpholin-4-yl)phenyl]morpholin-2-yl]acetyl]amino]-2-isocyanophenyl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydrochloride
CID 161313419
ethyl 2-[3-[(2R)-2-[(1R)-1-acetyloxy-2-[3-[[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-4-isocyanoanilino]-2-oxoethyl]-3-oxomorpholin-4-yl]phenoxy]acetate
CID 58290239
[(1R)-2-[3-[[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-4-cyanoanilino]-2-oxo-1-[(2R)-3-oxo-4-[3-(pyrrolidine-1-carbonyl)phenyl]morpholin-2-yl]ethyl] acetate
CID 67222212
2-[[3-[(2R)-2-[(1R)-2-(4-carbamimidoylanilino)-1-hydroxy-2-oxoethyl]-3-oxomorpholin-4-yl]benzoyl]-methylamino]acetic acid
CID 58181533
tert-butyl (2R)-2-hydroxy-2-[(2R)-4-[3-[methyl-(2-morpholin-4-yl-2-oxoethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetate
CID 58290515
tert-butyl (2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-phenylmethoxyethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetate
CID 58181985
tert-butyl N-[[2-cyano-5-[[2-hydroxy-2-[4-[3-[methyl-(2-morpholin-4-yl-2-oxoethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetyl]amino]phenyl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
CID 123809182
(2R)-2-acetyloxy-2-[(2R)-3-oxo-4-[3-(3-oxomorpholin-4-yl)phenyl]morpholin-2-yl]acetic acid;(2R)-2-hydroxy-N-(2-methyl-1H-inden-5-yl)-2-[(2R)-3-oxo-4-[3-(3-oxomorpholin-4-yl)phenyl]morpholin-2-yl]acetamide;methanol;2-methyl-1H-inden-5-amine;[(1R)-2-[(2-methyl-1H-inden-5-yl)amino]-2-oxo-1-[(2R)-3-oxo-4-[3-(3-oxomorpholin-4-yl)phenyl]morpholin-2-yl]ethyl] acetate
CID 158644312
methyl 2-[[3-[(2R)-2-[(1R)-2-[4-[(aminooxycarbonylamino)methyl]anilino]-1-hydroxy-2-oxoethyl]-3-oxomorpholin-4-yl]benzoyl]-methylamino]acetate
CID 118501201
[(1R)-2-(3-fluoro-4-isocyanoanilino)-2-oxo-1-[(2R)-3-oxo-4-[4-(trifluoromethyl)phenyl]morpholin-2-yl]ethyl] acetate
CID 58181728

Frequently Asked Questions

What is the IUPAC name of (2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate?
The IUPAC name of (2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate (CID 176526448) is (2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate.
What is the SMILES notation for (2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate?
The canonical SMILES for (2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate is CC(=O)O[C@@H](C(=O)O)[C@H]1OCCN(c2cccc(C(=O)N(C)CC(=O)N3CCCC3)c2)C1=O.O=C=O.O=C=O.[C-]#[N+]c1ccc(N)cc1C.[C-]#[N+]c1ccc(NC(=O)[C@H](OC(C)=O)[C@H]2OCCN(c3cccc(C(=O)N(C)CC(=O)N4CCCC4)c3)C2=O)cc1C.[H]/N=C1\N=C(N)c2ccc(NC(=O)[C@H](OC(C)=O)[C@H]3OCCN(c4cccc(C(=O)N(C)CC(=O)N5CCCC5)c4)C3=O)cc21.
What is the InChIKey of (2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate?
The InChIKey is JWGIBNZJYRKUKT-YZSRBQKFSA-N. The full InChI is InChI=1S/C30H33N7O7.C30H33N5O7.C22H27N3O8.C8H8N2.2CO2/c1-17(38)44-24(28(40)33-19-8-9-21-22(15-19)27(32)34-26(21)31)25-30(42)37(12-13-43-25)20-7-5-6-18(14-20)29(41)35(2)16-23(39)36-10-3-4-11-36;1-19-16-22(10-11-24(19)31-3)32-28(38)26(42-20(2)36)27-30(40)35(14-15-41-27)23-9-7-8-21(17-23)29(39)33(4)18-25(37)34-12-5-6-13-34;1-14(26)33-19(22(30)31)18-21(29)25(10-11-32-18)16-7-5-6-15(12-16)20(28)23(2)13-17(27)24-8-3-4-9-24;1-6-5-7(9)3-4-8(6)10-2;2*2-1-3/h5-9,14-15,24-25H,3-4,10-13,16H2,1-2H3,(H,33,40)(H3,31,32,34);7-11,16-17,26-27H,5-6,12-15,18H2,1-2,4H3,(H,32,38);5-7,12,18-19H,3-4,8-11,13H2,1-2H3,(H,30,31);3-5H,9H2,1H3;;/t24-,25-;26-,27-;18-,19-;;;/m111.../s1.
What are the key properties of (2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate?
(2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate has a molecular weight of 1860.91 g/mol, XLogP of 4.36, 23 rotatable bonds, 6 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-acetyloxy-2-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]acetic acid;[(1R)-2-[(1-amino-3-iminoisoindol-5-yl)amino]-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate;bis(carbon dioxide);4-isocyano-3-methylaniline;[(1R)-2-(4-isocyano-3-methylanilino)-1-[(2R)-4-[3-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]phenyl]-3-oxomorpholin-2-yl]-2-oxoethyl] acetate is sourced from PubChem (CID 176526448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).