![CAS 1609395-85-8 9-methyl-6-oxa-2,9-diazaspiro[4.5]decan-8-one hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1609395-85-8.gif)
CAS RN: 1609395-85-8
9-methyl-6-oxa-2,9-diazaspiro[4.5]decan-8-one hydrochloride
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.20250814 | 100mg / 250mg / 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS1609395-85-8
- Purity/Analytical Methods: >99.0%
1609395-85-8 / 9-methyl-6-oxa-2,9-diazaspiro[4.5]decan-8-one;hydrochloride
Basic Information
CAS
1609395-85-8
Multi CAS
No
Molecular Formula
C8H15ClN2O2
Molecular Weight
206.670000
Exact Mass
206.082205
SMILES
CN1CC2(CCNC2)OCC1=O.Cl
InChI
InChI=1S/C8H14N2O2.ClH/c1-10-6-8(2-3-9-5-8)12-4-7(10)11;/h9H,2-6H2,1H3;1H
InChIKey
PDUZELNRXMQSEV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
0.88
H-bond acceptors
3
H-bond donors
1
Molar refractivity
51.05
TPSA
41.57
LogP / Solubility
WLOGP
-0.37
MLOGP
-0.33
XLogP3
-0.37
Consensus LogP
-0.36
Log S (ESOL)
-0.89
Class (ESOL)
Very soluble
Log S (Ali)
-0.99
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.7
Class (SILICOS-IT)
Very 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)
-4.24
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
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