![CAS 5608-98-0 1-OXA-4-THIA-8-AZA-SPIRO[4.5]DECANE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/5608-98-0.gif)
CAS RN: 5608-98-0
1-OXA-4-THIA-8-AZA-SPIRO[4.5]DECANE
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.20251220 | 1g / 2.5g | Out of stock | 30 business days | Inquiry |
- Product code: starshine_CAS5608-98-0
- Purity/Analytical Methods: >99.0%
5608-98-0 / 1-oxa-4-thia-8-azaspiro[4.5]decane
Basic Information
CAS
5608-98-0
Multi CAS
Yes
Molecular Formula
C7H13NOS
Molecular Weight
159.250000
Exact Mass
159.071785
InChI
InChI=1S/C7H13NOS/c1-3-8-4-2-7(1)9-5-6-10-7/h8H,1-6H2
InChIKey
OAPBUOGJRXUBBH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
43.24
TPSA
21.26
LogP / Solubility
WLOGP
0.83
MLOGP
0.73
XLogP3
0.5
Consensus LogP
0.69
Log S (ESOL)
-1.35
Class (ESOL)
Soluble
Log S (Ali)
-1.46
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.38
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)
-3.1
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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