Basic information
- CAS
102144-78-5- Standard SMILES
Cn1c(=O)c2c(ncn2CCN2CCC(c3c[nH]c4ccccc34)CC2)n(C)c1=O- InChIKey
OJOSYHJYEWUYGU-UHFFFAOYSA-N- Molecular formula
- C22H26N6O2
- Average molar mass
- 406.5 g/mol
- Monoisotopic mass
- 406.21172409
Overview
Tameridone is a small molecule drug. Tameridone has a monoisotopic molecular weight of 406.21 Da.
Names & identifiers
- Preferred name
- Tameridone
- IUPAC
- 7-[2-[4-(1H-indol-3-yl)piperidin-1-yl]ethyl]-1,3-dimethylpurine-2,6-dione
- English name
- Tameridone
- Molecular formula
- C22H26N6O2
- Molecular weight
- 406.487
Names & synonyms
Tameridone102144-78-5Tameridonar 51 16374ATQ0K1LA7-[2-[4-(1H-indol-3-yl)piperidin-1-yl]ethyl]-1,3-dimethylpurine-2,6-dione1H-Purine-2,6-dione, 3,7-dihydro-7-(2-(4-(1H-indol-3-yl)-1-piperidinyl)ethyl)-1,3-dimethyl-7-(2-(4-Indol-3-ylpiperidino)ethyl)theophyllineR-51 163TameridonumTameridonum [Latin]Tameridona [Spanish]
Show more names
1H-Purine-2,6-dione, 3,7-dihydro-7-[2-[4-(1H-indol-3-yl)-1-piperidinyl]ethyl]-1,3-dimethyl-
7-[2-(4-Indol-3-ylpiperidino)ethyl]theophyllineSR-01000945141UNII-74ATQ0K1LATameridone [USAN:INN:BAN]TAMERIDONE [INN]Tameridone (USAN/INN)TAMERIDONE [USAN]MLS006011542
Database identifiers
- CAS
102144-78-5- PubChem CID
- 71304
- DTXSID
DTXSID90144705- ChEMBL
CHEMBL2104760- UNII
- 74ATQ0K1LA
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 77.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 666
Physicochemical properties
- FDA UNII
- 74 ATQ0K1LA · 74ATQ0K1LA
Chemistry & industry
Applications
UsesSedative (veterinary）.
Suppliers3 total
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
2 records
Compound notes
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