CAS RN: 874450-44-9
SEN 12333
Product Availability
Choose a grade to view its available package options.
12 package records12 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260621 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20250318 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250110 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20250225 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20260504 | 50mg | In stock | Shanghai, Shenzhen | Inquiry |
| Batchno.20250720 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS874450-44-9
- Purity/Analytical Methods: >99.0%
874450-44-9 / 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide
Basic Information
CAS
874450-44-9
Multi CAS
No
Molecular Formula
C20H25N3O2
Molecular Weight
339.400000
Exact Mass
339.194677
InChI
InChI=1S/C20H25N3O2/c24-20(5-1-2-11-23-12-14-25-15-13-23)22-19-8-6-17(7-9-19)18-4-3-10-21-16-18/h3-4,6-10,16H,1-2,5,11-15H2,(H,22,24)
InChIKey
XCHIZTUBUXZESJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
12
Fraction Csp3
0.4
Rotatable bonds
7
H-bond acceptors
4
H-bond donors
1
Molar refractivity
99.41
TPSA
54.46
LogP / Solubility
WLOGP
3.19
MLOGP
2.82
XLogP3
2
Consensus LogP
2.67
Log S (ESOL)
-3.85
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.65
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.35
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.53
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5
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