CAS RN: 1362154-70-8
GNE 617
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11 package records6 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260602 | 1ml | In stock | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
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| Batchno.20250625 | 100mg | Out of stock | Inquiry | |
| Batchno.20250811 | 10mg | Out of stock | Inquiry | |
| Batchno.20250801 | 1mg | Out of stock | Inquiry | |
| Batchno.20250425 | 25mg | Out of stock | Inquiry | |
| Batchno.20260305 | 2mg | In stock | Shanghai | Inquiry |
| Batchno.20250815 | 50mg | Out of stock | Inquiry | |
| Batchno.20250117 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1362154-70-8
- Purity/Analytical Methods: >99.0%
1362154-70-8 / N-[[4-(3,5-difluorophenyl)sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
Basic Information
CAS
1362154-70-8
Multi CAS
No
Molecular Formula
C21H15F2N3O3S
Molecular Weight
427.400000
Exact Mass
427.080219
SMILES
C1=CC(=CC=C1CNC(=O)C2=CN3C=CN=C3C=C2)S(=O)(=O)C4=CC(=CC(=C4)F)F
InChI
InChI=1S/C21H15F2N3O3S/c22-16-9-17(23)11-19(10-16)30(28,29)18-4-1-14(2-5-18)12-25-21(27)15-3-6-20-24-7-8-26(20)13-15/h1-11,13H,12H2,(H,25,27)
InChIKey
XRDVXQQZLHVEQZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
30
Aromatic heavy atom count
21
Fraction Csp3
0.05
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
1
Molar refractivity
104.61
TPSA
80.54
LogP / Solubility
WLOGP
3.38
MLOGP
3
XLogP3
3.5
Consensus LogP
3.29
Log S (ESOL)
-4.8
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.5
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.84
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.93
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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