CAS RN: 327036-89-5
4-Benzyl-2-methyl-1,2,4-thiadiazolidine-3,5-dione
Product Availability
Choose a grade to view its available package options.
10 package records9 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250414 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20250804 | 10mg | In stock | Shanghai, Wuhan | Inquiry |
| Batchno.20251008 | 1g | Out of stock | Inquiry | |
| Batchno.20250310 | 1mg | In stock | Shanghai, Wuhan | Inquiry |
| Batchno.20251013 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20260322 | 25mg / 100mg | Confirm by inquiry | Shanghai | Inquiry |
| Batchno.20251014 | 5mg | In stock | Shanghai | Inquiry |
- Product code: ICTB4436
- Purity/Analytical Methods: >98.0%(HPLC)
327036-89-5 / 4-benzyl-2-methyl-1,2,4-thiadiazolidine-3,5-dione
Basic Information
CAS
327036-89-5
Multi CAS
No
Molecular Formula
C10H10N2O2S
Molecular Weight
222.270000
Exact Mass
222.046299
InChI
InChI=1S/C10H10N2O2S/c1-11-9(13)12(10(14)15-11)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
InChIKey
JDSJDASOXWCHPN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
11
Fraction Csp3
0.2
Rotatable bonds
2
H-bond acceptors
5
Molar refractivity
59.36
TPSA
44
LogP / Solubility
WLOGP
0.66
MLOGP
0.58
XLogP3
1.5
Consensus LogP
0.91
Log S (ESOL)
-2.04
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.86
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.89
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.61
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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