CAS RN: 59454-35-2
10CB
Product Availability
Choose a grade to view its available package options.
6 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251007 | 10g | In stock | Shanghai | Inquiry | |
| Batchno.20250119 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20260118 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20250314 | 250mg / 1g | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20250819 | 25g | Out of stock | Inquiry | ||
| Batchno.20251115 | 5g | In stock | Shanghai, Wuhan | Inquiry |
- Product code: SSC-167896
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
59454-35-2 / 4-(4-decylphenyl)benzonitrile
Basic Information
CAS
59454-35-2
Multi CAS
Yes
Molecular Formula
C23H29N
Molecular Weight
319.500000
Exact Mass
319.230000
InChI
InChI=1S/C23H29N/c1-2-3-4-5-6-7-8-9-10-20-11-15-22(16-12-20)23-17-13-21(19-24)14-18-23/h11-18H,2-10H2,1H3
InChIKey
GLGZJMAYDWXROS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
12
Fraction Csp3
0.43
Rotatable bonds
10
H-bond acceptors
1
Molar refractivity
102.91
TPSA
23.79
LogP / Solubility
WLOGP
6.91
MLOGP
6.09
XLogP3
8.4
Consensus LogP
7.13
Log S (ESOL)
-5.88
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.17
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.67
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
0.24
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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