![CAS 707-15-3 6-METHYL-1,3-DIAZA-SPIRO[4.5]DECANE-2,4-DIONE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB5142217.gif)
CAS RN: 707-15-3
6-METHYL-1,3-DIAZA-SPIRO[4.5]DECANE-2,4-DIONE
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.20250905 | 1mg | Out of stock | 30 business days | Inquiry |
- Product code: starshine_CAS707-15-3
- Purity/Analytical Methods: >99.0%
707-15-3 / 6-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
Basic Information
CAS
707-15-3
Multi CAS
No
Molecular Formula
C9H14N2O2
Molecular Weight
182.220000
Exact Mass
182.105528
SMILES
CC1CCCCC12C(=O)NC(=O)N2
InChI
InChI=1S/C9H14N2O2/c1-6-4-2-3-5-9(6)7(12)10-8(13)11-9/h6H,2-5H2,1H3,(H2,10,11,12,13)
InChIKey
ZWONRJVAXSOJSB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
0.78
H-bond acceptors
2
H-bond donors
2
Molar refractivity
47.04
TPSA
58.2
LogP / Solubility
WLOGP
0.77
MLOGP
0.68
XLogP3
1
Consensus LogP
0.82
Log S (ESOL)
-1.46
Class (ESOL)
Soluble
Log S (Ali)
-1.61
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.49
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)
-3.28
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
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- CAS RN: 707-98-2
- Product Code: starshine_CAS707-98-2
- Purity/Analytical method: >99.0%
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