CAS RN: 426844-50-0
BOC-4,4-DIFLUORO-L-PROLINAMIDE
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.20251130 | 250mg / 1g / 5g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-150975
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, 1g, 5g
- 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.
426844-50-0 / tert-butyl 2-carbamoyl-4,4-difluoropyrrolidine-1-carboxylate
Basic Information
CAS
426844-50-0
Multi CAS
Yes
Molecular Formula
C10F2H16N2O3
Molecular Weight
250.240000
Exact Mass
250.112899
InChI
InChI=1S/C10H16F2N2O3/c1-9(2,3)17-8(16)14-5-10(11,12)4-6(14)7(13)15/h6H,4-5H2,1-3H3,(H2,13,15)
InChIKey
FBQFSNRSVLFGLE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Fraction Csp3
0.8
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
55.49
TPSA
72.63
LogP / Solubility
WLOGP
1.12
MLOGP
0.99
XLogP3
0.9
Consensus LogP
1
Log S (ESOL)
-2.03
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.42
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.33
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.45
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2
Customers Also Viewed
-
-
-
(2S,4S)-4-Fluoropyrrolidine-2-carbonitrile Hydrochloride
- CAS RN: 426844-77-1
- Product Code: SSC-150978
-
4-Hexyl-4H-dithieno[3,2-b:2′,3′-d]pyrrole)-dione
- CAS RN: 427875-87-4
- Product Code: starshine_CAS427875-87-4
- Purity/Analytical method: >99.0%
-
ETHYL 4-CHLORO-5-METHYLPYRROLO[2,1-F][1,2,4]TRIAZINE-6-CARBOXYLATE
- CAS RN: 427878-41-9
- Product Code: SSC-151052
-
Pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid, 1,4-dihydro-5-methyl-4-oxo-, ethyl ester
- CAS RN: 427878-70-4
- Product Code: SSC-151053
![CAS 427875-87-4 4-Hexyl-4H-dithieno[3,2-b:2′,3′-d]pyrrole)-dione molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/427875-87-4.gif)
![CAS 427878-41-9 ETHYL 4-CHLORO-5-METHYLPYRROLO[2,1-F][1,2,4]TRIAZINE-6-CARBOXYLATE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/427878-41-9.gif)
![CAS 427878-70-4 Pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid, 1,4-dihydro-5-methyl-4-oxo-, ethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/427878-70-4.gif)