Basic information
- CAS
72756-69-5- Standard SMILES
CC(=O)N(c1ccc(S(=O)(=O)Nc2cc(C)on2)cc1)[C@@H](CCC(N)=O)C(=O)O- InChIKey
DMSYWUMJYPNFOY-AWEZNQCLSA-N- Molecular formula
- C17H20N4O7S
- Average molar mass
- 424.4 g/mol
- Monoisotopic mass
- 424.10527016
Names & identifiers
- Preferred name
- N-acetyl-glutamylsulfamethoxazole
- IUPAC
- (2S)-2-[N-acetyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]anilino]-5-amino-5-oxopentanoic acid
- English name
- N-acetyl-glutamylsulfamethoxazole
- Molecular formula
- C17H20N4O7S
- Molecular weight
- 424.43
Names & synonyms
N-Acetyl-glutamylsulfamethoxazoleN-Agsm72756-69-5DTXSID30223063RefChem:162615DTXCID30145554(2S)-2-[N-acetyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]anilino]-5-amino-5-oxopentanoic acidN2-Acetyl-N-(4-(((5-methyl-3-isoxazolyl)amino)sulfonyl)phenyl)-L-glutamineL-Glutamine, N2-acetyl-N-(4-(((5-methyl-3-isoxazolyl)amino)sulfonyl)phenyl)-N~2~-Acetyl-N~2~-{4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl}-L-glutamineL-Glutamine, N2-acetyl-N-[4-[[(5-methyl-3-isoxazolyl)amino]sulfonyl]phenyl]-
Database identifiers
- CAS
72756-69-5- PubChem CID
- 175147
- DTXSID
DTXSID30223063
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 181 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 716
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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