Ivospemin tetrahydrochlorideProduct ingredient for Ivospemin
- Name
- Ivospemin tetrahydrochloride
- Drug Entry
- Ivospemin
- Accession Number
- DBSALT003382
- Structure
Structure for Ivospemin tetrahydrochloride (DBSALT003382)
- Synonyms
- (3S,12S)-N1,N14-Diethyl-3,12-dihydroxyhomospermine tetrahydrochloride / (6S,15S)-3,8,13,18-tetraazaicosane-6,15-diol tetrahydrochloride / 3,8,13,18-Tetraazaeicosane-6,15-diol, hydrochloride (1:4), (6S,15S)- / N1,N14-diethyl-3S,12S-dihydroxyhomospermine tetrahydrochloride / SBP-101 tetrahydrochloride
- UNII
- 2RKV12BBA7
- CAS Number
- 259657-09-5
- Weight
- Average: 464.34
Monoisotopic: 462.2061874 - Chemical Formula
- C16H42Cl4N4O2
- InChI Key
- SCDBHUCANIJZED-VNMXSFETSA-N
- InChI
- InChI=1S/C16H38N4O2.4ClH/c1-3-17-11-7-15(21)13-19-9-5-6-10-20-14-16(22)8-12-18-4-2;;;;/h15-22H,3-14H2,1-2H3;4*1H/t15-,16-;;;;/m0..../s1
- IUPAC Name
- (6S,15S)-3,8,13,18-tetraazaicosane-6,15-diol tetrahydrochloride
- SMILES
- Cl.Cl.Cl.Cl.CCNCC[C@H](O)CNCCCCNC[C@@H](O)CCNCC
- External Links
- ChemSpider
- 8870776
- Predicted Properties
Property Value Source logP -1.1 Chemaxon pKa (Strongest Acidic) 14.56 Chemaxon pKa (Strongest Basic) 10.73 Chemaxon Physiological Charge 4 Chemaxon Hydrogen Acceptor Count 6 Chemaxon Hydrogen Donor Count 6 Chemaxon Polar Surface Area 88.58 Å2 Chemaxon Rotatable Bond Count 17 Chemaxon Refractivity 93.53 m3·mol-1 Chemaxon Polarizability 40.35 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon