CAS RN: 603139-19-1
MK-0822
Product Availability
Choose a grade to view its available package options.
8 package records8 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251228 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260511 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250328 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20260107 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20260701 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20260530 | 2mg | In stock | Shanghai | Inquiry |
| Batchno.20251018 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20260408 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS603139-19-1
- Purity/Analytical Methods: >99.0%
603139-19-1 / (2S)-N-(1-cyanocyclopropyl)-4-fluoro-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-(4-methylsulfonylphenyl)phenyl]ethyl]amino]pentanamide
Basic Information
CAS
603139-19-1
Multi CAS
Yes
Molecular Formula
C25F4H27N3O3S
Molecular Weight
525.600000
Exact Mass
525.170926
InChI
InChI=1S/C25H27F4N3O3S/c1-23(2,26)14-20(22(33)32-24(15-30)12-13-24)31-21(25(27,28)29)18-6-4-16(5-7-18)17-8-10-19(11-9-17)36(3,34)35/h4-11,20-21,31H,12-14H2,1-3H3,(H,32,33)/t20-,21-/m0/s1
InChIKey
FWIVDMJALNEADT-SFTDATJTSA-N
Computed Properties
Structural Parameters
Heavy atom count
36
Aromatic heavy atom count
12
Fraction Csp3
0.44
Rotatable bonds
9
H-bond acceptors
5
H-bond donors
2
Molar refractivity
126.23
TPSA
99.06
LogP / Solubility
WLOGP
4.63
MLOGP
4.11
XLogP3
4.1
Consensus LogP
4.28
Log S (ESOL)
-5.67
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.21
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.64
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
5
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