![CAS 82452-93-5 Calix[8]arene molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/c1435-jpgcontextbwfzdgvyfhjvb3r8ndawmtr8aw1hz2uvanblz3xootcvadi2lzg5mjk0ndyxotkzmjyvqze0mzuuanbnfdfjy2eynzzmnjkynzqzzjrmnju2mtm0yjywnznlmti0ngmzngu4owu1njbhm2y5ntixowfizjjlmzm2nzzhmzi.jpeg)
CAS RN: 82452-93-5
Calix[8]arene
Product Availability
Choose a grade to view its available package options.
6 package records2 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260219 | 1g | Out of stock | Inquiry | |
| Batchno.20260310 | 1g | In stock | Shanghai, Guangdong | Inquiry |
| Batchno.20250803 | 250mg | Out of stock | Inquiry | |
| Batchno.20250416 | 25g | Out of stock | Inquiry | |
| Batchno.20251119 | 5g | Out of stock | Inquiry | |
| Batchno.20250306 | 5g | In stock | Shanghai, Shandong, Guangdong | Inquiry |
- Product code: ICTC1435
- Purity/Analytical Methods: >90.0%(HPLC)
82452-93-5 / nonacyclo[43.3.1.13,7.19,13.115,19.121,25.127,31.133,37.139,43]hexapentaconta-1(49),3(56),4,6,9(55),10,12,15(54),16,18,21(53),22,24,27,29,31(52),33,35,37(51),39,41,43(50),45,47-tetracosaene-49,50,51,52,53,54,55,56-octol
Basic Information
CAS
82452-93-5
Multi CAS
Yes
Molecular Formula
C56H48O8
Molecular Weight
849.000000
Exact Mass
848.334918
InChI
InChI=1S/C56H48O8/c57-49-33-9-1-10-34(49)26-36-12-3-14-38(51(36)59)28-40-16-5-18-42(53(40)61)30-44-20-7-22-46(55(44)63)32-48-24-8-23-47(56(48)64)31-45-21-6-19-43(54(45)62)29-41-17-4-15-39(52(41)60)27-37-13-2-11-35(25-33)50(37)58/h1-24,57-64H,25-32H2
InChIKey
HDPRHRZFFPXZIL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
64
Aromatic heavy atom count
48
Fraction Csp3
0.14
H-bond acceptors
8
H-bond donors
8
Molar refractivity
247.3
TPSA
161.84
LogP / Solubility
WLOGP
10.37
MLOGP
9.2
XLogP3
12.5
Consensus LogP
10.69
Log S (ESOL)
-12.19
Class (ESOL)
Insoluble
Log S (Ali)
-14.01
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-13.79
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.54
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
10
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