2-(Benzenesulfonamido)-5-(methylamino)-5-oxopentanoic acid
Basic information
- CAS
83870-88-6- Standard SMILES
CNC(=O)CCC(NS(=O)(=O)c1ccccc1)C(=O)O- InChIKey
NMHPHLIGGYQLLB-UHFFFAOYSA-N- Molecular formula
- C12H16N2O5S
- Average molar mass
- 300.33 g/mol
- Monoisotopic mass
- 300.07799279
Names & identifiers
- Preferred name
- 2-(Benzenesulfonamido)-5-(methylamino)-5-oxopentanoic acid
- IUPAC
- 2-(benzenesulfonamido)-5-(methylamino)-5-oxopentanoic acid
Names & synonyms
2-(benzenesulfonamido)-5-(methylamino)-5-oxopentanoic acidDTXSID9032026483870-88-6RefChem:253178DTXCID30271387NSC356806NSC-356806N~2~-(Benzenesulfonyl)-N-methylglutamine
Database identifiers
- CAS
83870-88-6- PubChem CID
- 337767
- DTXSID
DTXSID90320264
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 437
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Compound notes
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