CAS RN: 684236-01-9
CAY10698
Product Availability
Choose a grade to view its available package options.
13 package records12 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260423 | 50mg / 100mg / 250mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250630 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20250529 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250115 | 1g | Out of stock | Inquiry | |
| Batchno.20260220 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20250720 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20251122 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250301 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS684236-01-9
- Purity/Analytical Methods: >99.0%
684236-01-9 / 4-[(2-hydroxy-3-methoxyphenyl)methylamino]-N-(1,3-thiazol-2-yl)benzenesulfonamide
Basic Information
CAS
684236-01-9
Multi CAS
No
Molecular Formula
C17H17N3O4S2
Molecular Weight
391.500000
Exact Mass
391.066048
InChI
InChI=1S/C17H17N3O4S2/c1-24-15-4-2-3-12(16(15)21)11-19-13-5-7-14(8-6-13)26(22,23)20-17-18-9-10-25-17/h2-10,19,21H,11H2,1H3,(H,18,20)
InChIKey
CENSVXZQMJBVHY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
26
Aromatic heavy atom count
17
Fraction Csp3
0.12
Rotatable bonds
7
H-bond acceptors
7
H-bond donors
3
Molar refractivity
101.35
TPSA
100.55
LogP / Solubility
WLOGP
3.27
MLOGP
2.9
XLogP3
2.9
Consensus LogP
3.02
Log S (ESOL)
-4.35
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.13
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.76
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)
-2.79
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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