![CAS 345659-34-9 S-2,2′-dihydroxy-[1,1′-Binaphthalene]-3-carboxaldehyde molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/345659-34-9.gif)
CAS RN: 345659-34-9
S-2,2′-dihydroxy-[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.20250405 | 10mg / 50mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS345659-34-9
- Purity/Analytical Methods: >99.0%
345659-34-9 / 3-hydroxy-4-(2-hydroxynaphthalen-1-yl)naphthalene-2-carbaldehyde
Basic Information
CAS
345659-34-9
Multi CAS
No
Molecular Formula
C21H14O3
Molecular Weight
314.300000
Exact Mass
314.094294
InChI
InChI=1S/C21H14O3/c22-12-15-11-14-6-2-4-8-17(14)20(21(15)24)19-16-7-3-1-5-13(16)9-10-18(19)23/h1-12,23-24H
InChIKey
CZQYPRJUZNAMEG-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
20
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
95.61
TPSA
57.53
LogP / Solubility
WLOGP
4.88
MLOGP
4.31
XLogP3
5.4
Consensus LogP
4.86
Log S (ESOL)
-5.35
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.66
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6
Class (SILICOS-IT)
Slightly soluble
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
No
Log Kp (skin permeation)
-1.17
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
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![CAS 345892-71-9 BenzenesulfonaMide, 2,6-dichloro-N-[4-chloro-3-[2-(diMethylaMino)ethoxy]phenyl]-4-(trifluoroMethyl)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/345892-71-9.gif)
