CAS RN: 1082949-67-4
LY2584702
Product Availability
Choose a grade to view its available package options.
10 package records8 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250407 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20251225 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20250905 | 250mg | Out of stock | Inquiry | ||
| Batchno.20251213 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250919 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250219 | 5mg | In stock | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250729 | 25mg / 100mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1082949-67-4
- Purity/Analytical Methods: >99.0%
1082949-67-4 / 4-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-methylimidazol-2-yl]piperidin-1-yl]-1H-pyrazolo[5,4-d]pyrimidine
LY2584702 | LY-2584702 | LY 2584702
Basic Information
CAS
1082949-67-4
Multi CAS
Yes
Molecular Formula
C21H19F4N7
Molecular Weight
445.400000
Exact Mass
445.163806
SMILES
CN1C=C(N=C1C2CCN(CC2)C3=NC=NC4=C3C=NN4)C5=CC(=C(C=C5)F)C(F)(F)F
InChI
InChI=1S/C21H19F4N7/c1-31-10-17(13-2-3-16(22)15(8-13)21(23,24)25)29-19(31)12-4-6-32(7-5-12)20-14-9-28-30-18(14)26-11-27-20/h2-3,8-12H,4-7H2,1H3,(H,26,27,28,30)
InChIKey
FYXRSVDHGLUMHB-UHFFFAOYSA-N
Synonyms
LY2584702
LY-2584702
LY 2584702
4-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-methylimidazol-2-yl]piperidin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
I4965C6W4O
Computed Properties
Structural Parameters
Heavy atom count
32
Aromatic heavy atom count
20
Fraction Csp3
0.33
Rotatable bonds
3
H-bond acceptors
6
H-bond donors
1
Molar refractivity
109.48
TPSA
75.52
LogP / Solubility
WLOGP
4.3
MLOGP
3.81
XLogP3
3.6
Consensus LogP
3.9
Log S (ESOL)
-5.57
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.31
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.48
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.39
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
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![CAS 1082950-96-6 4-chloro-3-iodo-1H-pyrazolo[3,4-d]pyrimidine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1082950-96-6.gif)
