Foscarbidopa

C₁₀H₁₅N₂O₇P — CID 121288738

About Foscarbidopa

Foscarbidopa (PubChem CID 121288738) has the molecular formula C₁₀H₁₅N₂O₇P and a molecular weight of 306.21 g/mol. Its IUPAC name is (2S)-2-hydrazinyl-3-(3-hydroxy-4-phosphonooxyphenyl)-2-methylpropanoic acid.

Molecular Properties

• Compound Name: Foscarbidopa
• PubChem CID: 121288738
• Molecular Formula: C₁₀H₁₅N₂O₇P
• Molecular Weight: 306.21 g/mol
• Exact Mass: 306.06
• IUPAC Name: (2S)-2-hydrazinyl-3-(3-hydroxy-4-phosphonooxyphenyl)-2-methylpropanoic acid
• SMILES: C[C@@](Cc1ccc(OP(=O)(O)O)c(O)c1)(NN)C(=O)O
• InChI: InChI=1S/C10H15N2O7P/c1-10(12-11,9(14)15)5-6-2-3-8(7(13)4-6)19-20(16,17)18/h2-4,12-13H,5,11H2,1H3,(H,14,15)(H2,16,17,18)/t10-/m0/s1
• InChIKey: PQUZXFMHVSMUNG-JTQLQIEISA-N
• XLogP: -0.29
• TPSA: 162.34 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	306.21
LogP ≤ 5	-0.29
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of Foscarbidopa?

The IUPAC name of Foscarbidopa (CID 121288738) is (2S)-2-hydrazinyl-3-(3-hydroxy-4-phosphonooxyphenyl)-2-methylpropanoic acid.

What is the SMILES notation for Foscarbidopa?

The canonical SMILES for Foscarbidopa is C[C@@](Cc1ccc(OP(=O)(O)O)c(O)c1)(NN)C(=O)O.

What is the InChIKey of Foscarbidopa?

The InChIKey is PQUZXFMHVSMUNG-JTQLQIEISA-N. The full InChI is InChI=1S/C10H15N2O7P/c1-10(12-11,9(14)15)5-6-2-3-8(7(13)4-6)19-20(16,17)18/h2-4,12-13H,5,11H2,1H3,(H,14,15)(H2,16,17,18)/t10-/m0/s1.

What are the key properties of Foscarbidopa?

Foscarbidopa has a molecular weight of 306.21 g/mol, XLogP of -0.29, 6 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for Foscarbidopa is sourced from PubChem (CID 121288738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 121288738 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 5725 — approved-drug record (CC BY-SA 4.0)

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