(5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione

C113H123N15O23Si3 — CID 162170447

About (5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione

(5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione (PubChem CID 162170447) has the molecular formula C113H123N15O23Si3 and a molecular weight of 2143.57 g/mol. Its IUPAC name is (5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione.

Molecular Properties

• Compound Name: (5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione
• PubChem CID: 162170447
• Molecular Formula: C113H123N15O23Si3
• Molecular Weight: 2143.57 g/mol
• Exact Mass: 2141.82
• IUPAC Name: (5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione
• SMILES: CC#CCOc1ccc2c(c1)C(=O)N(C[C@@]1(c3ccccc3)NC(=O)N(COCC[Si](C)(C)C)C1=O)C2.COc1ccc2c(c1)C(=O)N(CC1(c3ccccc3)NC(=O)NC1=O)C2.C[Si](C)(C)CCOCN1C(=O)NC(CN2Cc3ccc(O)cc3C2=O)(c2ccccc2)C1=O.C[Si](C)(C)CCOCN1C(=O)N[C@@](CN2Cc3ccc(O)cc3C2=O)(c2ccccc2)C1=O.O=C1NC(=O)C(CN2Cc3ccc(O)cc3C2=O)(c2ccccc2)N1
• InChI: InChI=1S/C28H33N3O5Si.2C24H29N3O5Si.C19H17N3O4.C18H15N3O4/c1-5-6-14-36-23-13-12-21-18-30(25(32)24(21)17-23)19-28(22-10-8-7-9-11-22)26(33)31(27(34)29-28)20-35-15-16-37(2,3)4;2*1-33(2,3)12-11-32-16-27-22(30)24(25-23(27)31,18-7-5-4-6-8-18)15-26-14-17-9-10-19(28)13-20(17)21(26)29;1-26-14-8-7-12-10-22(16(23)15(12)9-14)11-19(13-5-3-2-4-6-13)17(24)20-18(25)21-19;22-13-7-6-11-9-21(15(23)14(11)8-13)10-18(12-4-2-1-3-5-12)16(24)19-17(25)20-18/h7-13,17H,14-16,18-20H2,1-4H3,(H,29,34);2*4-10,13,28H,11-12,14-16H2,1-3H3,(H,25,31);2-9H,10-11H2,1H3,(H2,20,21,24,25);1-8,22H,9-10H2,(H2,19,20,24,25)/t28-;24-;;;/m00.../s1
• InChIKey: ZNSGIHBXIQEHJX-SVZHADMCSA-N
• XLogP: 12.49
• TPSA: 473.02 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 23
• Rotatable Bonds: 33
• Heavy Atoms: 154
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2143.57
LogP ≤ 5	12.49
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione?

The IUPAC name of (5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione (CID 162170447) is (5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione.

What is the SMILES notation for (5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione?

The canonical SMILES for (5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione is CC#CCOc1ccc2c(c1)C(=O)N(C[C@@]1(c3ccccc3)NC(=O)N(COCC[Si](C)(C)C)C1=O)C2.COc1ccc2c(c1)C(=O)N(CC1(c3ccccc3)NC(=O)NC1=O)C2.C[Si](C)(C)CCOCN1C(=O)NC(CN2Cc3ccc(O)cc3C2=O)(c2ccccc2)C1=O.C[Si](C)(C)CCOCN1C(=O)N[C@@](CN2Cc3ccc(O)cc3C2=O)(c2ccccc2)C1=O.O=C1NC(=O)C(CN2Cc3ccc(O)cc3C2=O)(c2ccccc2)N1.

What is the InChIKey of (5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione?

The InChIKey is ZNSGIHBXIQEHJX-SVZHADMCSA-N. The full InChI is InChI=1S/C28H33N3O5Si.2C24H29N3O5Si.C19H17N3O4.C18H15N3O4/c1-5-6-14-36-23-13-12-21-18-30(25(32)24(21)17-23)19-28(22-10-8-7-9-11-22)26(33)31(27(34)29-28)20-35-15-16-37(2,3)4;2*1-33(2,3)12-11-32-16-27-22(30)24(25-23(27)31,18-7-5-4-6-8-18)15-26-14-17-9-10-19(28)13-20(17)21(26)29;1-26-14-8-7-12-10-22(16(23)15(12)9-14)11-19(13-5-3-2-4-6-13)17(24)20-18(25)21-19;22-13-7-6-11-9-21(15(23)14(11)8-13)10-18(12-4-2-1-3-5-12)16(24)19-17(25)20-18/h7-13,17H,14-16,18-20H2,1-4H3,(H,29,34);2*4-10,13,28H,11-12,14-16H2,1-3H3,(H,25,31);2-9H,10-11H2,1H3,(H2,20,21,24,25);1-8,22H,9-10H2,(H2,19,20,24,25)/t28-;24-;;;/m00.../s1.

What are the key properties of (5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione?

(5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione has a molecular weight of 2143.57 g/mol, XLogP of 12.49, 33 rotatable bonds, 10 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for (5R)-5-[(5-but-2-ynoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione;5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;(5R)-5-[(5-hydroxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenyl-3-(2-trimethylsilylethoxymethyl)imidazolidine-2,4-dione;5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 162170447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).