![CAS 349149-07-1 S-2,2′-bis(methoxymethoxy)-[1,1′-Binaphthalene]-3-carboxaldehyde molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/349149-07-1.gif)
CAS RN: 349149-07-1
S-2,2′-bis(methoxymethoxy)-[1,1′-Binaphthalene]-3-carboxaldehyde
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250330 | 25mg / 100mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS349149-07-1
- Purity/Analytical Methods: >99.0%
349149-07-1 / 3-(methoxymethoxy)-4-[2-(methoxymethoxy)naphthalen-1-yl]naphthalene-2-carbaldehyde
Basic Information
CAS
349149-07-1
Multi CAS
No
Molecular Formula
C25H22O5
Molecular Weight
402.400000
Exact Mass
402.146724
InChI
InChI=1S/C25H22O5/c1-27-15-29-22-12-11-17-7-3-5-9-20(17)23(22)24-21-10-6-4-8-18(21)13-19(14-26)25(24)30-16-28-2/h3-14H,15-16H2,1-2H3
InChIKey
VHZOSUKNHURZON-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
30
Aromatic heavy atom count
20
Fraction Csp3
0.16
Rotatable bonds
8
H-bond acceptors
5
Molar refractivity
117.29
TPSA
53.99
LogP / Solubility
WLOGP
5.44
MLOGP
4.81
XLogP3
5.4
Consensus LogP
5.22
Log S (ESOL)
-5.73
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.79
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.75
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.31
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
3
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