Azonam

C₁₃H₁₇N₅O₈S₂ — CID 135398736

About Azonam

Azonam (PubChem CID 135398736) has the molecular formula C₁₃H₁₇N₅O₈S₂ and a molecular weight of 435.44 g/mol. Its IUPAC name is (2S,3S)-3-[[(2Z)-2-(2-amino-1,3-thiazol-3-ium-4-yl)-2-(2-carboxypropan-2-yloxyimino)acetyl]amino]-2-methyl-4-oxoazetidine-1-sulfonate.

Molecular Properties

• Compound Name: Azonam
• PubChem CID: 135398736
• Molecular Formula: C₁₃H₁₇N₅O₈S₂
• Molecular Weight: 435.44 g/mol
• Exact Mass: 435.05
• IUPAC Name: (2S,3S)-3-[[(2Z)-2-(2-amino-1,3-thiazol-3-ium-4-yl)-2-(2-carboxypropan-2-yloxyimino)acetyl]amino]-2-methyl-4-oxoazetidine-1-sulfonate
• SMILES: C[C@H]1[C@H](NC(=O)/C(=N\OC(C)(C)C(=O)O)c2csc(N)[nH+]2)C(=O)N1S(=O)(=O)[O-]
• InChI: InChI=1S/C13H17N5O8S2/c1-5-7(10(20)18(5)28(23,24)25)16-9(19)8(6-4-27-12(14)15-6)17-26-13(2,3)11(21)22/h4-5,7H,1-3H3,(H2,14,15)(H,16,19)(H,21,22)(H,23,24,25)/b17-8-/t5-,7-/m0/s1
• InChIKey: WZPBZJONDBGPKJ-VEHQQRBSSA-N
• XLogP: -2.10
• TPSA: 205.66 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 10
• Rotatable Bonds: 7
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	435.44
LogP ≤ 5	-2.10
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of Azonam?

The IUPAC name of Azonam (CID 135398736) is (2S,3S)-3-[[(2Z)-2-(2-amino-1,3-thiazol-3-ium-4-yl)-2-(2-carboxypropan-2-yloxyimino)acetyl]amino]-2-methyl-4-oxoazetidine-1-sulfonate.

What is the SMILES notation for Azonam?

The canonical SMILES for Azonam is C[C@H]1[C@H](NC(=O)/C(=N\OC(C)(C)C(=O)O)c2csc(N)[nH+]2)C(=O)N1S(=O)(=O)[O-].

What is the InChIKey of Azonam?

The InChIKey is WZPBZJONDBGPKJ-VEHQQRBSSA-N. The full InChI is InChI=1S/C13H17N5O8S2/c1-5-7(10(20)18(5)28(23,24)25)16-9(19)8(6-4-27-12(14)15-6)17-26-13(2,3)11(21)22/h4-5,7H,1-3H3,(H2,14,15)(H,16,19)(H,21,22)(H,23,24,25)/b17-8-/t5-,7-/m0/s1.

What are the key properties of Azonam?

Azonam has a molecular weight of 435.44 g/mol, XLogP of -2.10, 7 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for Azonam is sourced from PubChem (CID 135398736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 135398736 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 279 — approved-drug record (CC BY-SA 4.0)

How this page is built: methodology · editorial policy & corrections.