Moexiprilat hydrochlorideProduct ingredient for Moexiprilat
- Name
- Moexiprilat hydrochloride
- Drug Entry
- Moexiprilat
The active metabolite of the prodrug Moexipril.
- Accession Number
- DBSALT002760
- Structure
Structure for Moexiprilat hydrochloride (DBSALT002760)
- Synonyms
- Moexiprilat HCl
- UNII
- 54BP281YEW
- CAS Number
- 82586-57-0
- Weight
- Average: 506.98
Monoisotopic: 506.181979 - Chemical Formula
- C25H31ClN2O7
- InChI Key
- ZVLZMESUJYRKKI-ZAFWUOJLSA-N
- InChI
- InChI=1S/C25H30N2O7.ClH/c1-15(26-19(24(29)30)10-9-16-7-5-4-6-8-16)23(28)27-14-18-13-22(34-3)21(33-2)12-17(18)11-20(27)25(31)32;/h4-8,12-13,15,19-20,26H,9-11,14H2,1-3H3,(H,29,30)(H,31,32);1H/t15-,19-,20-;/m0./s1
- IUPAC Name
- (3S)-2-[(2S)-2-{[(1S)-1-carboxy-3-phenylpropyl]amino}propanoyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrochloride
- SMILES
- Cl.COC1=C(OC)C=C2CN([C@@H](CC2=C1)C(O)=O)C(=O)[C@H](C)N[C@@H](CCC1=CC=CC=C1)C(O)=O
- External Links
- ChemSpider
- 32697723
- Predicted Properties
Property Value Source Water Solubility 0.0303 mg/mL ALOGPS logP 0.89 ALOGPS logP 0.074 Chemaxon logS -4.2 ALOGPS pKa (Strongest Acidic) 2.91 Chemaxon pKa (Strongest Basic) 7.8 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 8 Chemaxon Hydrogen Donor Count 3 Chemaxon Polar Surface Area 125.4 Å2 Chemaxon Rotatable Bond Count 10 Chemaxon Refractivity 123.36 m3·mol-1 Chemaxon Polarizability 48.31 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon