CAS RN: 99495-90-6
(R)-Flecainide
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251210 | 1mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS99495-90-6
- Purity/Analytical Methods: >99.0%
99495-90-6 / N-(piperidin-2-ylmethyl)-2,5-bis(2,2,2-trifluoroethoxy)benzamide
Basic Information
CAS
99495-90-6
Multi CAS
Yes
Molecular Formula
C17F6H20N2O3
Molecular Weight
414.340000
Exact Mass
414.137811
InChI
InChI=1S/C17H20F6N2O3/c18-16(19,20)9-27-12-4-5-14(28-10-17(21,22)23)13(7-12)15(26)25-8-11-3-1-2-6-24-11/h4-5,7,11,24H,1-3,6,8-10H2,(H,25,26)/t11-/m1/s1
InChIKey
DJBNUMBKLMJRSA-LLVKDONJSA-N
Physical Properties
Melting Point
228-229
Physical Description
Solid
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
28
Aromatic heavy atom count
6
Fraction Csp3
0.59
Rotatable bonds
7
H-bond acceptors
4
H-bond donors
2
Molar refractivity
87.52
TPSA
59.59
LogP / Solubility
WLOGP
3.44
MLOGP
3.05
XLogP3
3.8
Consensus LogP
3.43
Log S (ESOL)
-4.27
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.44
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.05
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.8
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
Customers Also Viewed
-
1-PHENYL-3-(TRIFLUOROMETHYL)PYRAZOLE
- CAS RN: 99498-65-4
- Product Code: starshine_CAS99498-65-4
- Purity/Analytical method: >99.0%
-
-
N-chlorocarbonyloxy-5-norborene-2,3,-dicarboximide
- CAS RN: 99502-89-3
- Product Code: SSC-213208
-
Benzoic acid, 3-amino-4-nitro-, methyl ester (9CI)
- CAS RN: 99512-09-1
- Product Code: SSC-213212
-
-
