Agn 203818 HydrochlorideProduct ingredient for Rezatomidine
- Name
- Agn 203818 Hydrochloride
- Drug Entry
- Rezatomidine
Rezatomidine has been used in trials studying the treatment of Fibromyalgia, Cystitis, Interstitial, Irritable Bowel Syndrome, and Diabetic Neuropathy, Painful.
- Accession Number
- DBSALT002143
- Structure
Structure for Agn 203818 Hydrochloride (DBSALT002143)
- Synonyms
- Not Available
- UNII
- 1C25MR0H0E
- CAS Number
- 1021954-16-4
- Weight
- Average: 268.8
Monoisotopic: 268.0800974 - Chemical Formula
- C13H17ClN2S
- InChI Key
- FKVKHBODOZRGOP-PPHPATTJSA-N
- InChI
- InChI=1S/C13H16N2S.ClH/c1-8-5-4-6-11(9(8)2)10(3)12-7-14-13(16)15-12;/h4-7,10H,1-3H3,(H2,14,15,16);1H/t10-;/m0./s1
- IUPAC Name
- 4-[(1S)-1-(2,3-dimethylphenyl)ethyl]-2,3-dihydro-1H-imidazole-2-thione hydrochloride
- SMILES
- Cl.C[C@H](C1=CNC(=S)N1)C1=C(C)C(C)=CC=C1
- External Links
- ChemSpider
- 32700182
- Predicted Properties
Property Value Source Water Solubility 0.0111 mg/mL ALOGPS logP 2.74 ALOGPS logP 3.77 Chemaxon logS -4.3 ALOGPS pKa (Strongest Acidic) 9.98 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 0 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 24.06 Å2 Chemaxon Rotatable Bond Count 2 Chemaxon Refractivity 73.33 m3·mol-1 Chemaxon Polarizability 26.53 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon