Glycine, N-(((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)thio)-N-methyl-, ethyl ester
Basic information
- CAS
82560-44-9- Standard SMILES
CCOC(=O)CN(C)SN(C)C(=O)Oc1cccc2c1OC(C)(C)C2- InChIKey
SLWMSLOKPHTANY-UHFFFAOYSA-N- Molecular formula
- C17H24N2O5S
- Average molar mass
- 368.4 g/mol
- Monoisotopic mass
- 368.14059304
Names & identifiers
- Preferred name
- Glycine, N-(((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)thio)-N-methyl-, ethyl ester
- IUPAC
- ethyl 2-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-methylamino]acetate
Names & synonyms
82560-44-9Glycine, N-(((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)thio)-N-methyl-, ethyl esterDTXSID80231850RefChem:346342DTXCID10154341SCHEMBL10483145Ethyl N-{[{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]carbonyl}(methyl)amino]sulfanyl}-N-methylglycinate
Database identifiers
- CAS
82560-44-9- PubChem CID
- 3067971
- DTXSID
DTXSID80231850
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 93.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 488
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…