CAS RN: 1393465-84-3
PLX7904
Product Availability
Choose a grade to view its available package options.
7 package records3 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250428 | 100mg | Out of stock | Inquiry | ||
| Batchno.20260607 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20260121 | 25mg | Out of stock | Inquiry | ||
| Batchno.20260113 | 2mg | In stock | Shanghai | Inquiry | |
| Batchno.20251120 | 50mg | Out of stock | Inquiry | ||
| Batchno.20250620 | 5mg | In stock | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260303 | 1mg / 5mg / 25mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1393465-84-3
- Purity/Analytical Methods: >99.0%
1393465-84-3 / 5-(2-cyclopropylpyrimidin-5-yl)-3-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorobenzoyl]-1H-pyrrolo[2,3-b]pyridine
Basic Information
CAS
1393465-84-3
Multi CAS
No
Molecular Formula
C24H22F2N6O3S
Molecular Weight
512.500000
Exact Mass
512.144216
SMILES
CCN(C)S(=O)(=O)NC1=C(C(=C(C=C1)F)C(=O)C2=CNC3=C2C=C(C=N3)C4=CN=C(N=C4)C5CC5)F
InChI
InChI=1S/C24H22F2N6O3S/c1-3-32(2)36(34,35)31-19-7-6-18(25)20(21(19)26)22(33)17-12-30-24-16(17)8-14(9-29-24)15-10-27-23(28-11-15)13-4-5-13/h6-13,31H,3-5H2,1-2H3,(H,29,30)
InChIKey
DKNZQPXIIHLUHU-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
36
Aromatic heavy atom count
21
Fraction Csp3
0.25
Rotatable bonds
8
H-bond acceptors
6
H-bond donors
2
Molar refractivity
129.73
TPSA
120.94
LogP / Solubility
WLOGP
4.01
MLOGP
3.57
XLogP3
2.6
Consensus LogP
3.39
Log S (ESOL)
-5.45
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.66
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.28
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)
-3
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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