![CAS 912265-92-0 3a,6,7,7a-Tetrahydro-4H-isoxazolo[4,5-c]pyridine-3,5-dicarboxylic acid 5-tert-butyl ester 3-ethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/912265-92-0.gif)
CAS RN: 912265-92-0
3a,6,7,7a-Tetrahydro-4H-isoxazolo[4,5-c]pyridine-3,5-dicarboxylic acid 5-tert-butyl ester 3-ethyl ester
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.20260323 | 100mg / 250mg / 1g | Out of stock | 15 business days | Inquiry |
- Product code: SSC-204098
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: 1g
- 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 |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Shanghai | Inquiry |
912265-92-0 / 5-O-tert-butyl 3-O-ethyl 6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3,5-dicarboxylate
Basic Information
CAS
912265-92-0
Multi CAS
No
Molecular Formula
C14H20N2O5
Molecular Weight
296.320000
Exact Mass
296.137222
InChI
InChI=1S/C14H20N2O5/c1-5-19-12(17)11-9-8-16(7-6-10(9)21-15-11)13(18)20-14(2,3)4/h5-8H2,1-4H3
InChIKey
WSXJTHQHXVIFET-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
5
Fraction Csp3
0.64
Rotatable bonds
2
H-bond acceptors
6
Molar refractivity
72.81
TPSA
81.87
LogP / Solubility
WLOGP
2.14
MLOGP
1.9
XLogP3
1.7
Consensus LogP
1.91
Log S (ESOL)
-3.07
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.54
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.61
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5
Customers Also Viewed
-
![CAS 912265-93-1 3a,6,7,7a-Tetrahydro-4H-isoxazolo[4,5-c]pyridine-3,5-dicarboxylic acid 5-tert-butyl ester molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
3a,6,7,7a-Tetrahydro-4H-isoxazolo[4,5-c]pyridine-3,5-dicarboxylic acid 5-tert-butyl ester
- CAS RN: 912265-93-1
- Product Code: SSC-204099
-
tert-butyl 7-formyl-3,4-dihydro-1,8-naphthyridine-1(2H)-carboxylate
- CAS RN: 912270-39-4
- Product Code: SSC-204100
-
5H-Cyclopenta[b]pyridin-7-ol, 6,7-dihydro,(7R)-
- CAS RN: 912277-45-3
- Product Code: SSC-204101
-
-
-
Karavilagenin A
- CAS RN: 912329-03-4
- Product Code: starshine_CAS912329-03-4
- Purity/Analytical method: >99.0%
![CAS 912265-93-1 3a,6,7,7a-Tetrahydro-4H-isoxazolo[4,5-c]pyridine-3,5-dicarboxylic acid 5-tert-butyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/912265-93-1.gif)
![CAS 912277-45-3 5H-Cyclopenta[b]pyridin-7-ol, 6,7-dihydro,(7R)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/912277-45-3.gif)
