Basic information
- CAS
918333-06-9- Standard SMILES
CC(C)(C)CCN1CCC(CNC(=O)c2cc(Cl)cc(Cl)c2)C(F)C1- InChIKey
HQZBFDAIHIKVRO-UHFFFAOYSA-N- Molecular formula
- C19H27Cl2FN2O
- Average molar mass
- 389.3 g/mol
- Monoisotopic mass
- 388.148447
Names & identifiers
- Preferred name
- Benzamide, 3,5-dichloro-N-[[(3S,4R)-1-(3,3-dimethylbutyl)-3-fluoro-4-piperidinyl]methyl]-
- IUPAC
- 3,5-dichloro-N-[[1-(3,3-dimethylbutyl)-3-fluoropiperidin-4-yl]methyl]benzamide
- English name
- BenzaMide, 3,5-dichloro-N-[[(3S,4R)-1-(3,3-diMethylbutyl)-3-fluoro-4-piperidinyl]Methyl]-
- Molecular formula
- C19H27Cl2FN2O
- Molecular weight
- 389.3348832
Names & synonyms
Benzamide, 3,5-dichloro-N-[[(3S,4R)-1-(3,3-dimethylbutyl)-3-fluoro-4-piperidinyl]methyl]-SCHEMBL3515947DTXSID0013526003,5-Dichloro-N-{[1-(3,3-dimethylbutyl)-3-fluoro-4-piperidinyl]methyl}benzamideTTA-P1
Database identifiers
- CAS
918333-06-9- PubChem CID
- 16005753
- DTXSID
DTXSID001352600
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 434
Chemistry & industry
Applications
UsesTTA-P1 is a potent state-independent compound inhibiting human T-type calcium channel. T-type calcium channels play a role in diverse physiological responses including neuronal burst firing, hormone secretion, and cell growth. TTA-P1 has the potential for the research of absence epilepsy[1].
Suppliers1 total
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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