Basic information
- CAS
83198-90-7- Standard SMILES
CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.Cc1c(CC(C)C)sc2nc(C(=O)O)[nH]c(=O)c12- InChIKey
OPEPFDHEYUYTMO-WZTVWXICSA-N- Molecular formula
- C19H31N3O8S
- Average molar mass
- 461.5 g/mol
- Monoisotopic mass
- 461.18318613
Names & identifiers
- Preferred name
- Tiprinast Meglumine
- IUPAC
- (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol;5-methyl-6-(2-methylpropyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-2-carboxylic acid
Names & synonyms
TIPRINAST MEGLUMINETiprinast meglumine [USAN]UNII-7GWN8D71657GWN8D716583198-90-7MJ 12,175-170Tiprinast meglumine (USAN)MJ-12175-170Thieno(2,3-d)pyrimidine-2-carboxylic acid, 3,4-dihydro-5-methyl-6-(2-methylpropyl)-4-oxo, compound with 1-deoxy-1-(methylamino)-D-glucitol (1:1)D-GLUCITOL, 1-DEOXY-1-(METHYLAMINO)-, 1,4-DIHYDRO-5-METHYL-6-(2-METHYLPROPYL)-4-OXOTHIENO(2,3-D)PYRIMIDINE-2-CARBOXYLATE (1:1)RefChem:190114CHEMBL3989897
Show more names
SCHEMBL11183679D06163Q272682693,4-Dihydro-6-isobutyl-5-methyl-4-oxothieno(2,3-d)pyrimidine-2-carboxylic acid, compound with 1-deoxy-1-(methylamino)-D-glucitol (1:1)
Database identifiers
- CAS
83198-90-7- PubChem CID
- 15917700
- ChEMBL
CHEMBL3989897- UNII
- 7GWN8D7165
Properties
Computed structural properties
- Topological polar surface area
- 220 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 542
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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