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TTA-A2

CAT: 1410-M25008-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M25008-01Size:5 mg
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Description
TTA-A2 is a selective T-type calcium channel antagonist as a potent anticonvulsant that the Cav3.1 isoform plays a prominent role in mediating.
CAS Number
953778-63-7
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
378.4
Molecular Formula
C20H21F3N2O2
Notes
Research use only, not for human use.
Receptor
Cav3.1 (a1G) |Cav3.2 (a1H)

Chemical Information

Tta-A2
CAS Number953778-63-7
PubChem CID53317097
IUPAC Name2-(4-cyclopropylphenyl)-N-[(1R)-1-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]ethyl]acetamide
Molecular FormulaC20H21F3N2O2
Molecular Weight378.4
XLogP4
Topological Polar Surface Area51.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count27
Formal Charge0
Complexity488
SMILES
C[C@H](C1=NC=C(C=C1)OCC(F)(F)F)NC(=O)CC2=CC=C(C=C2)C3CC3
InChI
InChI=1S/C20H21F3N2O2/c1-13(18-9-8-17(11-24-18)27-12-20(21,22)23)25-19(26)10-14-2-4-15(5-3-14)16-6-7-16/h2-5,8-9,11,13,16H,6-7,10,12H2,1H3,(H,25,26)/t13-/m1/s1
InChIKey
GEYDMBNDOVPFJL-CYBMUJFWSA-N
Chemical Structure
2D Structure
2D structure of Tta-A2
CAS: 953778-63-7
CID: 53317097
Formula: C20H21F3N2O2
MW: 378.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight378.4
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass378.15551240
Monoisotopic Mass378.15551240
Topological Polar Surface Area51.2 Ų
Heavy Atom Count27
Formal Charge0
Complexity488
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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