CAS RN: 52364-72-4
4-Cyano-4′-heptyloxybiphenyl
Product Availability
Choose a grade to view its available package options.
10 package records9 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260122 | 1g / 5g / 10g / 25g | Out of stock | 5-7 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260227 | 10g | In stock | Shanghai, Shenzhen, Chengdu | Inquiry | |
| Batchno.20250322 | 1g | In stock | Shanghai, Chengdu | Inquiry | |
| Batchno.20260202 | 250mg | In stock | Shanghai, Chengdu | Inquiry | |
| Batchno.20250728 | 25g | In stock | Shanghai, Shenzhen | Inquiry | |
| Batchno.20260128 | 5g | In stock | Chengdu | Inquiry |
- Product code: SSC-159469
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: 5g
- Available purity: ＞97%
- 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 |
|---|---|---|---|---|
| 5g | ＞97% | 0 Out of Stock | Shenzhen | Inquiry |
52364-72-4 / 4-(4-heptoxyphenyl)benzonitrile
Basic Information
CAS
52364-72-4
Multi CAS
Yes
Molecular Formula
C20H23NO
Molecular Weight
293.400000
Exact Mass
293.177964
InChI
InChI=1S/C20H23NO/c1-2-3-4-5-6-15-22-20-13-11-19(12-14-20)18-9-7-17(16-21)8-10-18/h7-14H,2-6,15H2,1H3
InChIKey
JPBFKTCKZLMJED-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
12
Fraction Csp3
0.35
Rotatable bonds
8
H-bond acceptors
2
Molar refractivity
90.85
TPSA
33.02
LogP / Solubility
WLOGP
5.57
MLOGP
4.92
XLogP3
6.1
Consensus LogP
5.53
Log S (ESOL)
-5.05
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.99
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-7.15
Class (SILICOS-IT)
Insoluble
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
No
Log Kp (skin permeation)
-0.55
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
