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Padsevonil

CAT: 1596-AR-P01059-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-P01059-02Size:25 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1294000-61-5
Synonyms
(R) -4- (2-chloro-2,2-difluoroethyl) -1- ((2- (methoxymethyl) -6- (trifluoromethyl) imidazo[2,1-b][1,3,4]thiadiazol-5-yl) methyl) pyrrolidin-2-one
Molecular Formula
C14H14ClF5N4O2S
Molecular Weight
432.79
API Name
Padsevonil

Chemical Information

Padsevonil

Padsevonil is under investigation in clinical trial NCT03695094 (A Study in Participants With Epilepsy, to Evaluate the Pharmacokinetics, Safety and Tolerability of Oxcarbazepine on Padsevonil).

CAS Number1294000-61-5
PubChem CID52911611
IUPAC Name(4R)-4-(2-chloro-2,2-difluoroethyl)-1-[[2-(methoxymethyl)-6-(trifluoromethyl)imidazo[2,1-b][1,3,4]thiadiazol-5-yl]methyl]pyrrolidin-2-one
Molecular FormulaC14H14ClF5N4O2S
Molecular Weight432.8
XLogP2.5
Topological Polar Surface Area88
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count6
Heavy Atom Count27
Formal Charge0
Complexity572
SMILES
COCC1=NN2C(=C(N=C2S1)C(F)(F)F)CN3C[C@H](CC3=O)CC(F)(F)Cl
InChI
InChI=1S/C14H14ClF5N4O2S/c1-26-6-9-22-24-8(11(14(18,19)20)21-12(24)27-9)5-23-4-7(2-10(23)25)3-13(15,16)17/h7H,2-6H2,1H3/t7-/m1/s1
InChIKey
DCXFIOLWWRXEQH-SSDOTTSWSA-N
Chemical Structure
2D Structure
2D structure of Padsevonil
CAS: 1294000-61-5
CID: 52911611
Formula: C14H14ClF5N4O2S
MW: 432.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight432.8
XLogP32.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count6
Exact Mass432.0446154
Monoisotopic Mass432.0446154
Topological Polar Surface Area88 Ų
Heavy Atom Count27
Formal Charge0
Complexity572
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

Alternative Products

CatalogName
MBS3601189-01Padsevonil
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A19462-100Padsevonil 100mg
A19462-50Padsevonil 50mg
A19462-10Padsevonil 10mg
A19462-1Padsevonil 1mg
A19462-5Padsevonil 5mg

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