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CAS RN: 1435467-37-0
PF-06282999
Product Availability
Choose a grade to view its available package options.
8 package records4 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260306 | 5mg / 25mg / 100mg | Out of stock | 5-7 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250119 | 100mg | Out of stock | Inquiry | ||
| Batchno.20250405 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20250103 | 1mg | In stock | Wuhan | Inquiry | |
| Batchno.20260625 | 250mg | Out of stock | Inquiry | ||
| Batchno.20250528 | 25mg | In stock | Wuhan | Inquiry | |
| Batchno.20260404 | 50mg | Out of stock | Inquiry | ||
| Batchno.20250325 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1435467-37-0
- Purity/Analytical Methods: >99.0%
1435467-37-0 / 2-[6-(5-chloro-2-methoxyphenyl)-4-oxo-2-sulfanylidenepyrimidin-1-yl]acetamide
Basic Information
CAS
1435467-37-0
Multi CAS
No
Molecular Formula
C13H12ClN3O3S
Molecular Weight
325.770000
Exact Mass
325.028790
SMILES
COC1=C(C=C(C=C1)Cl)C2=CC(=O)NC(=S)N2CC(=O)N
InChI
InChI=1S/C13H12ClN3O3S/c1-20-10-3-2-7(14)4-8(10)9-5-12(19)16-13(21)17(9)6-11(15)18/h2-5H,6H2,1H3,(H2,15,18)(H,16,19,21)
InChIKey
ICYNYWFGIDGBRD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
12
Fraction Csp3
0.15
Rotatable bonds
4
H-bond acceptors
5
H-bond donors
2
Molar refractivity
82.08
TPSA
90.11
LogP / Solubility
WLOGP
1.72
MLOGP
1.53
XLogP3
1
Consensus LogP
1.42
Log S (ESOL)
-3.1
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.47
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.69
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.49
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5
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