CAS RN: 57603-82-4
5-(PYRIMIDIN-2-YLSULFANYL)-FURAN-2-CARBALDEHYDE
Product Availability
Choose a grade to view its available package options.
4 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250222 | 1g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20260604 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20260215 | 250mg / 1g / 5g | Confirm by inquiry | Shanghai | 5-7 business days | Inquiry |
| Batchno.20251030 | 5g | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS57603-82-4
- Purity/Analytical Methods: >99.0%
57603-82-4 / 5-pyrimidin-2-ylsulfanylfuran-2-carbaldehyde
Basic Information
CAS
57603-82-4
Multi CAS
No
Molecular Formula
C9H6N2O2S
Molecular Weight
206.220000
Exact Mass
206.014999
InChI
InChI=1S/C9H6N2O2S/c12-6-7-2-3-8(13-7)14-9-10-4-1-5-11-9/h1-6H
InChIKey
BVGQOPQJOBCDBN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
11
Rotatable bonds
3
H-bond acceptors
5
Molar refractivity
50.25
TPSA
55.99
LogP / Solubility
WLOGP
2.03
MLOGP
1.79
XLogP3
1.8
Consensus LogP
1.87
Log S (ESOL)
-2.78
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.72
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.05
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.53
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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