CAS RN: 407634-05-3
1-(2-METHOXY-ETHYL)-5-OXO-PYRROLIDINE-3-CARBOXYLIC ACID
- Product code: SSC-149106
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 0.1g, 0.25g, 5g, 1g, 10g, 25g
- Available purity: >97%
- Inventory rows with stock: 3
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 0.1g | >97% | 2 In Stock | Shanghai | Inquiry |
| 0.25g | >97% | 2 In Stock | Shenzhen | Inquiry |
| 5g | >97% | 1 In Stock | Shenzhen | Inquiry |
| 1g | >97% | 0 Out of Stock | Shanghai | Inquiry |
| 10g | >97% | 0 Out of Stock | Shanghai | Inquiry |
| 25g | >97% | 0 Out of Stock | Hong Kong | Inquiry |
407634-05-3 / 1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxylic acid
Basic Information
CAS
407634-05-3
Multi CAS
Yes
Molecular Formula
C8H13NO4
Molecular Weight
187.190000
Exact Mass
187.084458
InChI
InChI=1S/C8H13NO4/c1-13-3-2-9-5-6(8(11)12)4-7(9)10/h6H,2-5H2,1H3,(H,11,12)
InChIKey
SQFXUCKQOKOBLC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
0.75
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
1
Molar refractivity
44.2
TPSA
66.84
LogP / Solubility
WLOGP
-0.43
MLOGP
-0.38
XLogP3
-1.2
Consensus LogP
-0.67
Log S (ESOL)
-0.46
Class (ESOL)
Very soluble
Log S (Ali)
-0.78
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
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)
-4.17
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
![CAS 408314-14-7 1H-1,2,3-TRIAZOLO[4,5-B]PYRIDINE, 6-CHLORO- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/408314-14-7.gif)