![CAS 58610-65-4 ETHYL 2-(6′-CYANO-5′-OXO-3′,5′-DIHYDRO-2’H-SPIRO[[1,3]DIOXOLANE-2,1′-INDOLIZINE]-7′-YL)ACETATE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/58610-65-4.gif)
CAS RN: 58610-65-4
ETHYL 2-(6′-CYANO-5′-OXO-3′,5′-DIHYDRO-2’H-SPIRO[[1,3]DIOXOLANE-2,1′-INDOLIZINE]-7′-YL)ACETATE
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.20250926 | 100mg / 250mg | Out of stock | 15 business days | Inquiry |
- Product code: SSC-166903
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: 10g
- 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 |
|---|---|---|---|---|
| 10g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
58610-65-4 / ethyl 2-(6'-cyano-5'-oxospiro[1,3-dioxolane-2,1'-2,3-dihydroindolizine]-7'-yl)acetate
Basic Information
CAS
58610-65-4
Multi CAS
No
Molecular Formula
C15H16N2O5
Molecular Weight
304.300000
Exact Mass
304.105922
InChI
InChI=1S/C15H16N2O5/c1-2-20-13(18)8-10-7-12-15(21-5-6-22-15)3-4-17(12)14(19)11(10)9-16/h7H,2-6,8H2,1H3
InChIKey
FQVVPISPHQOPFC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.53
Rotatable bonds
3
H-bond acceptors
7
Molar refractivity
73.95
TPSA
90.55
LogP / Solubility
WLOGP
0.43
MLOGP
0.39
XLogP3
-0.6
Consensus LogP
0.07
Log S (ESOL)
-2
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.36
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.35
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.27
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3.5
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Spiro[1,3-dioxolane-2,1′(5’H)-indolizine]-7′-acetic acid, 6′-cyano-α-ethyl-2′,3′-dihydro-5′-oxo-, ethyl ester
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Cyclobutane-1α,2β-dicarboxylic acid
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- Purity/Analytical method: >99.0%
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![CAS 58610-66-5 Spiro[1,3-dioxolane-2,1′(5’H)-indolizine]-7′-acetic acid, 6′-cyano-α-ethyl-2′,3′-dihydro-5′-oxo-, ethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/58610-66-5.gif)
