(5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione

C88H73N17O21 — CID 157345748

About (5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione

(5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione (PubChem CID 157345748) has the molecular formula C88H73N17O21 and a molecular weight of 1704.65 g/mol. Its IUPAC name is (5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione.

Molecular Properties

• Compound Name: (5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione
• PubChem CID: 157345748
• Molecular Formula: C88H73N17O21
• Molecular Weight: 1704.65 g/mol
• Exact Mass: 1703.52
• IUPAC Name: (5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione
• SMILES: COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4c(=O)[nH]ccc4o3)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4c(C)nc(C)cc4o3)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4cc(-c5ccncc5)cnc4o3)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4cnc(C)cc4o3)NC(=O)NC1=O)C2
• InChI: InChI=1S/C25H19N5O5.C22H20N4O5.C21H18N4O5.C20H16N4O6/c1-34-18-3-2-15-12-30(22(31)19(15)10-18)13-25(23(32)28-24(33)29-25)20-9-16-8-17(11-27-21(16)35-20)14-4-6-26-7-5-14;1-11-6-17-15(12(2)23-11)8-18(31-17)22(20(28)24-21(29)25-22)10-26-9-13-4-5-14(30-3)7-16(13)19(26)27;1-11-5-16-13(8-22-11)6-17(30-16)21(19(27)23-20(28)24-21)10-25-9-12-3-4-14(29-2)7-15(12)18(25)26;1-29-11-3-2-10-8-24(17(26)12(10)6-11)9-20(18(27)22-19(28)23-20)15-7-13-14(30-15)4-5-21-16(13)25/h2-11H,12-13H2,1H3,(H2,28,29,32,33);4-8H,9-10H2,1-3H3,(H2,24,25,28,29);3-8H,9-10H2,1-2H3,(H2,23,24,27,28);2-7H,8-9H2,1H3,(H,21,25)(H2,22,23,27,28)/t25-;22-;21-;20-/m0000/s1
• InChIKey: BGYFVKPYJKLNOG-XTAXCUEBSA-N
• XLogP: 7.39
• TPSA: 487.94 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 25
• Rotatable Bonds: 17
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1704.65
LogP ≤ 5	7.39
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione?

The IUPAC name of (5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione (CID 157345748) is (5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione.

What is the SMILES notation for (5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione?

The canonical SMILES for (5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione is COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4c(=O)[nH]ccc4o3)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4c(C)nc(C)cc4o3)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4cc(-c5ccncc5)cnc4o3)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4cnc(C)cc4o3)NC(=O)NC1=O)C2.

What is the InChIKey of (5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione?

The InChIKey is BGYFVKPYJKLNOG-XTAXCUEBSA-N. The full InChI is InChI=1S/C25H19N5O5.C22H20N4O5.C21H18N4O5.C20H16N4O6/c1-34-18-3-2-15-12-30(22(31)19(15)10-18)13-25(23(32)28-24(33)29-25)20-9-16-8-17(11-27-21(16)35-20)14-4-6-26-7-5-14;1-11-6-17-15(12(2)23-11)8-18(31-17)22(20(28)24-21(29)25-22)10-26-9-13-4-5-14(30-3)7-16(13)19(26)27;1-11-5-16-13(8-22-11)6-17(30-16)21(19(27)23-20(28)24-21)10-25-9-12-3-4-14(29-2)7-15(12)18(25)26;1-29-11-3-2-10-8-24(17(26)12(10)6-11)9-20(18(27)22-19(28)23-20)15-7-13-14(30-15)4-5-21-16(13)25/h2-11H,12-13H2,1H3,(H2,28,29,32,33);4-8H,9-10H2,1-3H3,(H2,24,25,28,29);3-8H,9-10H2,1-2H3,(H2,23,24,27,28);2-7H,8-9H2,1H3,(H,21,25)(H2,22,23,27,28)/t25-;22-;21-;20-/m0000/s1.

What are the key properties of (5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione?

(5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione has a molecular weight of 1704.65 g/mol, XLogP of 7.39, 17 rotatable bonds, 9 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for (5S)-5-(4,6-dimethylfuro[3,2-c]pyridin-2-yl)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(6-methylfuro[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-oxo-5H-furo[3,2-c]pyridin-2-yl)imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(5-pyridin-4-ylfuro[2,3-b]pyridin-2-yl)imidazolidine-2,4-dione is sourced from PubChem (CID 157345748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).