![CAS 215433-53-7 (1’R)- [2,3′:1′,1”:3”,2”’-Quaternaphthalene]-2′,2”-diol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/215433-53-7.gif)
CAS RN: 215433-53-7
(1’R)- [2,3′:1′,1”:3”,2”’-Quaternaphthalene]-2′,2”-diol
Product Availability
Choose a grade to view its available package options.
9 package records8 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260507 | 100mg / 250mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: SSC-103232
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: 0.1g
- 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 |
|---|---|---|---|---|
| 0.1g | ＞97% | 0 Out of Stock | Shenzhen | Inquiry |
215433-53-7 / 1-(2-hydroxy-3-naphthalen-2-ylnaphthalen-1-yl)-3-naphthalen-2-ylnaphthalen-2-ol
Basic Information
CAS
215433-53-7
Multi CAS
No
Molecular Formula
C40H26O2
Molecular Weight
538.600000
Exact Mass
538.193280
SMILES
C1=CC=C2C=C(C=CC2=C1)C3=CC4=CC=CC=C4C(=C3O)C5=C(C(=CC6=CC=CC=C65)C7=CC8=CC=CC=C8C=C7)O
InChI
InChI=1S/C40H26O2/c41-39-35(31-19-17-25-9-1-3-11-27(25)21-31)23-29-13-5-7-15-33(29)37(39)38-34-16-8-6-14-30(34)24-36(40(38)42)32-20-18-26-10-2-4-12-28(26)22-32/h1-24,41-42H
InChIKey
MUSCVMJLGBQKID-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
42
Aromatic heavy atom count
40
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
2
Molar refractivity
176.1
TPSA
40.46
LogP / Solubility
WLOGP
10.71
MLOGP
9.47
XLogP3
11.1
Consensus LogP
10.43
Log S (ESOL)
-10.43
Class (ESOL)
Insoluble
Log S (Ali)
-11.71
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.41
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
1.6
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
6.5
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