CAS RN: 342779-66-2
NCRW0005-F05
Product Availability
Choose a grade to view its available package options.
7 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260529 | 100mg | Out of stock | Inquiry | |
| Batchno.20260419 | 10mg | Out of stock | Inquiry | |
| Batchno.20250219 | 1mg | Out of stock | Inquiry | |
| Batchno.20250512 | 25mg | Out of stock | Inquiry | |
| Batchno.20250708 | 50mg | Out of stock | Inquiry | |
| Batchno.20260626 | 5mg | Out of stock | Inquiry | |
| Batchno.20250110 | 5mg / 25mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS342779-66-2
- Purity/Analytical Methods: >99.0%
342779-66-2 / (4R)-3,3-difluoro-4-(4-methoxyphenyl)-1-phenylazetidin-2-one
Basic Information
CAS
342779-66-2
Multi CAS
Yes
Molecular Formula
C16F2H13NO2
Molecular Weight
289.280000
Exact Mass
289.091435
InChI
InChI=1S/C16H13F2NO2/c1-21-13-9-7-11(8-10-13)14-16(17,18)15(20)19(14)12-5-3-2-4-6-12/h2-10,14H,1H3
InChIKey
AIIIYUSGINMZMS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
12
Fraction Csp3
0.19
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
74.61
TPSA
29.54
LogP / Solubility
WLOGP
3.42
MLOGP
3.02
XLogP3
3.2
Consensus LogP
3.21
Log S (ESOL)
-4.01
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.4
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.74
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.06
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3
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