![CAS 1439897-97-8 4-oxa-1,9-diazaspiro[5.5]undecane dihydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1439897-97-8.gif)
CAS RN: 1439897-97-8
4-oxa-1,9-diazaspiro[5.5]undecane dihydrochloride
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.20260301 | 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-055232
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: 0.25g
- Available purity: ≥95%
- 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 |
|---|---|---|---|---|
| 0.25g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
1439897-97-8 / 4-oxa-1,9-diazaspiro[5.5]undecane;dihydrochloride
Basic Information
CAS
1439897-97-8
Multi CAS
No
Molecular Formula
C8H18Cl2N2O
Molecular Weight
229.140000
Exact Mass
228.079619
SMILES
C1CNCCC12COCCN2.Cl.Cl
InChI
InChI=1S/C8H16N2O.2ClH/c1-3-9-4-2-8(1)7-11-6-5-10-8;;/h9-10H,1-7H2;2*1H
InChIKey
NHCTZADTIPXKLD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
58.15
TPSA
33.29
LogP / Solubility
WLOGP
0.57
MLOGP
0.51
XLogP3
0.57
Consensus LogP
0.55
Log S (ESOL)
-1.62
Class (ESOL)
Soluble
Log S (Ali)
-1.85
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.62
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
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)
-3.71
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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