CAS RN: 39890-45-4
1-((PYRROLIDINE-1-CARBONYL)METHYL)PIPERAZINE
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260422 | 250mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: SSC-147665
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 5g
- Available purity: ≥97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | ≥97% | 0 Out of Stock | Shenzhen | Inquiry |
39890-45-4 / 2-piperazin-1-yl-1-pyrrolidin-1-ylethanone
Basic Information
CAS
39890-45-4
Multi CAS
Yes
Molecular Formula
C10H19N3O
Molecular Weight
197.280000
Exact Mass
197.152812
InChI
InChI=1S/C10H19N3O/c14-10(13-5-1-2-6-13)9-12-7-3-11-4-8-12/h11H,1-9H2
InChIKey
KYBCXTTWIOZBNR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Fraction Csp3
0.9
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
55.12
TPSA
35.58
LogP / Solubility
WLOGP
-0.49
MLOGP
-0.43
XLogP3
-0.4
Consensus LogP
-0.44
Log S (ESOL)
-0.62
Class (ESOL)
Very soluble
Log S (Ali)
-0.83
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.78
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)
-4.27
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
![CAS 39890-46-5 4-[2-(PIPERAZIN-1-YL)-ACETYL]-MORPHOLINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/39890-46-5.gif)
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