CAS RN: 897958-24-6
2-(2-methoxyethoxy)pyridine-4-carboxylic acid
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.20250424 | 100mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS897958-24-6
- Purity/Analytical Methods: >99.0%
897958-24-6 / 2-(2-methoxyethoxy)pyridine-4-carboxylic acid
Basic Information
CAS
897958-24-6
Multi CAS
No
Molecular Formula
C9H11NO4
Molecular Weight
197.190000
Exact Mass
197.068808
InChI
InChI=1S/C9H11NO4/c1-13-4-5-14-8-6-7(9(11)12)2-3-10-8/h2-3,6H,4-5H2,1H3,(H,11,12)
InChIKey
VGBPUMOJCXEQQV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
5
H-bond acceptors
4
H-bond donors
1
Molar refractivity
48.57
TPSA
68.65
LogP / Solubility
WLOGP
0.81
MLOGP
0.71
XLogP3
1
Consensus LogP
0.84
Log S (ESOL)
-1.56
Class (ESOL)
Soluble
Log S (Ali)
-1.76
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.21
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.35
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
-
L-Tyrosine, O-[2-[[(1,1-dimethylethoxy)carbonyl]amino]ethyl]-, methyl ester
- CAS RN: 897962-34-4
- Product Code: SSC-201862
-
-
-
![CAS 897962-34-4 L-Tyrosine, O-[2-[[(1,1-dimethylethoxy)carbonyl]amino]ethyl]-, methyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/897962-34-4.gif)
