Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UKNOWN

Structure

InChI Key UXZAJSZFFARTEI-YRPNKDGESA-N
Smile COC(=O)N1CCC[C@H](NS(C)(=O)=O)[C@@H]1CO[C@H]1CC[C@@H](c2ccccc2)CC1
InChI
InChI=1S/C21H32N2O5S/c1-27-21(24)23-14-6-9-19(22-29(2,25)26)20(23)15-28-18-12-10-17(11-13-18)16-7-4-3-5-8-16/h3-5,7-8,17-20,22H,6,9-15H2,1-2H3/t17-,18+,19-,20-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H32N2O5S
Molecular Weight 424.56
AlogP 2.88
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 6.0
Polar Surface Area 84.94
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 29.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Narcolepsy 1 D009290 ClinicalTrials
Sleep Apnea, Obstructive 1 D020181 ClinicalTrials
Narcolepsy 1 D009290 ClinicalTrials
Idiopathic Hypersomnia 1 D020177 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL4650341