Glycine, N-(1-oxo-2-(((3-phenyl-1,2,4-oxadiazol-5-yl)methyl)thio)propyl)-, (+-)-
Basic information
- CAS
61560-18-7- Standard SMILES
CC(SCc1nc(-c2ccccc2)no1)C(=O)NCC(=O)O- InChIKey
RVINKJMACQUZPK-UHFFFAOYSA-N- Molecular formula
- C14H15N3O4S
- Average molar mass
- 321.35 g/mol
- Monoisotopic mass
- 321.07832714
Names & identifiers
- Preferred name
- Glycine, N-(1-oxo-2-(((3-phenyl-1,2,4-oxadiazol-5-yl)methyl)thio)propyl)-, (+-)-
- IUPAC
- 2-[2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanoylamino]acetic acid
Names & synonyms
2-(S-(3-Phenyl-1,2,4-oxadiazol-5-yl)methyl)thiopropionylglycine61560-18-7(+-)-N-(1-Oxo-2-(((3-phenyl-1,2,4-oxadiazol-5-yl)methyl)thio)propyl)glycineGlycine, N-(1-oxo-2-(((3-phenyl-1,2,4-oxadiazol-5-yl)methyl)thio)propyl)-, (+-)-RefChem:34639571484-14-52-(2-(((3-Phenyl-1,2,4-oxadiazol-5-yl)methyl)thio)propanamido)acetic acidDTXSID20977149N-(1-Hydroxy-2-{[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}propylidene)glycine
Database identifiers
- CAS
61560-18-7- PubChem CID
- 3046121
- DTXSID
DTXSID20977149
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 390
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Compound notes
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