Cephalexin S-sulfoxide

Base Information

• Chemical Name: Cephalexin S-sulfoxide
• CAS No.: 74708-55-7
• Molecular Formula: C16H17N3O5S
• Molecular Weight: 363.4
• UNII: 2SHL9V57MY
• Mol file: 74708-55-7.mol

Synonyms:Cephalexin S-sulfoxide;2SHL9V57MY;UNII-2SHL9V57MY;74708-55-7;(6R,7R)-7-((R)-2-Amino-2-phenylacetamido)-3-methyl-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid 5S-oxide;5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2R)-2-amino-2-phenylacetyl)amino)-3-methyl-8-oxo-, 5-oxide, (5S,6R,7R)-

Chemical Property of Cephalexin S-sulfoxide

Chemical Property:

• XLogP3: -3.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 363.08889182
• Heavy Atom Count: 25
• Complexity: 671

Purity/Quality:

99% ^*data from raw suppliers

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MSDS Files:

Useful:

• Canonical SMILES: CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=CC=C3)N)S(=O)C1)C(=O)O
• Isomeric SMILES: CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)[S@@](=O)C1)C(=O)O

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