![CAS 36908-76-6 1,2-Diazaspiro[2.5]oct-1-ene-6-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/36908-76-6.gif)
CAS RN: 36908-76-6
1,2-Diazaspiro[2.5]oct-1-ene-6-carboxylic acid
Product Availability
Choose a grade to view its available package options.
4 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260219 | 100mg | In stock | Shanghai, Tianjin, Chengdu | Inquiry | |
| Batchno.20250201 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20250207 | 1g | In stock | Shanghai, Tianjin, Chengdu | Inquiry | |
| Batchno.20260420 | 250mg | In stock | Shanghai, Shenzhen, Chengdu | Inquiry |
- Product code: starshine_CAS36908-76-6
- Purity/Analytical Methods: >99.0%
36908-76-6 / 1,2-diazaspiro[2.5]oct-1-ene-6-carboxylic acid
Basic Information
CAS
36908-76-6
Multi CAS
No
Molecular Formula
C7H10N2O2
Molecular Weight
154.170000
Exact Mass
154.074228
InChI
InChI=1S/C7H10N2O2/c10-6(11)5-1-3-7(4-2-5)8-9-7/h5H,1-4H2,(H,10,11)
InChIKey
PYHDUXONODREIA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
0.86
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
37.18
TPSA
62.02
LogP / Solubility
WLOGP
1.42
MLOGP
1.25
XLogP3
0.9
Consensus LogP
1.19
Log S (ESOL)
-1.63
Class (ESOL)
Soluble
Log S (Ali)
-1.85
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.96
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)
-2.65
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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