SCH-50910 free base
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Basic information
- CAS
790633-59-9- Standard SMILES
CC1(C)CO[C@H](CC(=O)O)CN1- InChIKey
SEYCKMQSPUVYEF-ZCFIWIBFSA-N- Molecular formula
- C8H15NO3
- Average molar mass
- 173.21 g/mol
- Monoisotopic mass
- 173.10519334
Names & identifiers
- Preferred name
- SCH-50910 free base
- IUPAC
- 2-[(2R)-5,5-dimethylmorpholin-2-yl]acetic acid
- English name
- 2-Morpholineacetic acid, 5,5-dimethyl-, (2R)-
- Molecular formula
- C8H15NO3
- Molecular weight
- 173.21
Names & synonyms
SCH-50910 free base790633-59-9SCH 50910 free base2-Morpholineacetic acid, 5,5-dimethyl-, (2R)-UNII-8WV6113NSP8WV6113NSPDTXSID60229518RefChem:181786DTXCID101520092-[(2R)-5,5-dimethylmorpholin-2-yl]acetic acid(R)-2-(5,5-Dimethylmorpholin-2-yl)acetic acidTocris-0984
Show more names
SCH50910SCH 50910SCH 50910 free base,SCH50910 free base(2R)-5,5-dimethyl-2-Morpholineacetic acid(R)-(5,5-Dimethyl-morpholin-2-yl)-acetic acid(2R)-(+)-(5,5-Dimethyl-morpholin-2-yl)-acetic acid
orb1699347CHEMBL1395421AKOS040749462NCGC00024915-01CS-0370237T28729[(2R)-5,5-Dimethylmorpholin-2-yl]acetic acidQ27271138
Database identifiers
- CAS
790633-59-9- PubChem CID
- 6604787
- DTXSID
DTXSID60229518- ChEMBL
CHEMBL1395421- UNII
- 8WV6113NSP
- Nikkaji
- J1.023.849H
Properties
Computed structural propertiesFilling in
- XLogP
- -2.7
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 179
Physicochemical properties
- Boiling point
- 305.5 · 305.5±17.0 °C(Predicted)
- Density
- 1.055 · 1.055±0.06 g/cm3(Predicted)
- pka
- 4.09 · 4.09±0.10(Predicted)
- FDA UNII
- 8 WV6113NSP · 8WV6113NSP
Chemistry & industry
Applications
UsesSch 50910 is a GABA(B) receptor antagonist with some activity in inhibiting GABA(B) autoreceptors. Sch 50910 had no effect on electrically stimulated release at a concentration of 100 μM. The activity of Sch 50910 suggests that it may not have a significant role in studies of GABA(B) receptor function[1].
Related reactions
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Compound notes
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