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Chemical structure of L-368,899 hydrochloride

GC16620

L-368,899 hydrochloride

Also known as (2S)-2-amino-N-[(2S)-7,7-dimethyl-1-[[4-(2-methylphenyl)piperazin-1-yl]sulfonylmethyl]-2-bicyclo[2.2.1]heptanyl]-4-methylsulfonylbutanamide;hydrochloride

L-368,899 hydrochloride is an orally active and selective OT (oxytocin ) receptor antagonist, with IC50s of 8·9 and 26 nM for uterus of rat and human, respectively

ChemicalCAS160312-62-9MW591.23FormulaC26H42N4O5S2·HCl
CAS number
160312-62-9
Molecular weight
591.23
Formula
C26H42N4O5S2·HCl
Solubility
DMSO: 100 mM,Water: 100 mM
InChIKey
GIUFQWFJHXXXEQ-PHSYAEQHSA-N
Catalogue number
GC16620
Brand
GLPBIO
Computed properties PubChem CID 90488775 · TPSA 147 Ų · H-bond donors 3 · H-bond acceptors 8
TPSA
147 Ų
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
9
Heavy atoms
38

SMILES CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)CC34CCC(C3(C)C)C[C@@H]4NC(=O)[C@H](CCS(=O)(=O)C)N.Cl

Computed descriptors from PubChem (CID 90488775), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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