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Chemical structure of MDL 100009 - MDL 100907, (S)-(-)-

GB40272

MDL 100009 - MDL 100907, (S)-(-)-

Also known as (S)-(2,3-dimethoxyphenyl)-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol

S-enantiomer of MDL 100151; opposite enantiomer of MDL 100907 , selective 5-HT2A antagonist

ChemicalCAS175673-57-1MW373.46FormulaC22H28FNO3
CAS number
175673-57-1
Molecular weight
373.46
Formula
C22H28FNO3
InChIKey
HXTGXYRHXAGCFP-NRFANRHFSA-N
Catalogue number
GB40272
Brand
GLPBIO
Computed properties PubChem CID 11953651 · XLogP 3.9 · TPSA 41.9 Ų · H-bond donors 1
XLogP
3.9
TPSA
41.9 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
27

SMILES COC1=CC=CC(=C1OC)[C@H](C2CCN(CC2)CCC3=CC=C(C=C3)F)O

Computed descriptors from PubChem (CID 11953651), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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