CAS RN: 791835-21-7
BI-6C9
Product Availability
Choose a grade to view its available package options.
8 package records7 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251120 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250522 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20250509 | 1mg | In stock | Shanghai | Inquiry | |
| Batchno.20250326 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20250609 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250328 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20260101 | 5mg | In stock | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250812 | 5mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS791835-21-7
- Purity/Analytical Methods: >99.0%
791835-21-7 / N-[4-(4-aminophenyl)sulfanylphenyl]-4-[(4-methoxyphenyl)sulfonylamino]butanamide
Basic Information
CAS
791835-21-7
Multi CAS
Yes
Molecular Formula
C23H25N3O4S2
Molecular Weight
471.600000
Exact Mass
471.128649
InChI
InChI=1S/C23H25N3O4S2/c1-30-19-8-14-22(15-9-19)32(28,29)25-16-2-3-23(27)26-18-6-12-21(13-7-18)31-20-10-4-17(24)5-11-20/h4-15,25H,2-3,16,24H2,1H3,(H,26,27)
InChIKey
LCFUJBSKPDPGKO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
32
Aromatic heavy atom count
18
Fraction Csp3
0.17
Rotatable bonds
10
H-bond acceptors
6
H-bond donors
3
Molar refractivity
127.47
TPSA
110.52
LogP / Solubility
WLOGP
4.13
MLOGP
3.66
XLogP3
3.4
Consensus LogP
3.73
Log S (ESOL)
-5.12
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.41
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.35
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.67
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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