CAS RN: 517870-19-8
Methyl 5-(3-methoxyphenyl)isoxazole-3-carboxylate
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.20260109 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-158741
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 | Shenzhen | Inquiry |
517870-19-8 / methyl 5-(3-methoxyphenyl)-1,2-oxazole-3-carboxylate
Basic Information
CAS
517870-19-8
Multi CAS
No
Molecular Formula
C12H11NO4
Molecular Weight
233.220000
Exact Mass
233.068808
InChI
InChI=1S/C12H11NO4/c1-15-9-5-3-4-8(6-9)11-7-10(13-17-11)12(14)16-2/h3-7H,1-2H3
InChIKey
BUYQDAXEBRVQAB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
11
Fraction Csp3
0.17
Rotatable bonds
3
H-bond acceptors
5
Molar refractivity
59.83
TPSA
61.56
LogP / Solubility
WLOGP
2.14
MLOGP
1.88
XLogP3
2.2
Consensus LogP
2.07
Log S (ESOL)
-2.91
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.02
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.31
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.63
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
5-(3-Methoxy-phenyl)-2H-pyrazole-3-carboxylic acid methyl ester
- CAS RN: 517870-26-7
- Product Code: SSC-158745
-
1,4-BENZODIOXANE-6-BORONIC ACID, PINACOL ESTER
- CAS RN: 517874-21-4
- Product Code: SSC-158746
-
6-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydronaphthalen-1(2H)-one
- CAS RN: 517874-22-5
- Product Code: SSC-158747
-
2-(2,2-Difluoro-2H-1,3-benzodioxol-5-yl)-4,4,5,5-tetraMethyl-1,3,2-dioxaborolane
- CAS RN: 517874-23-6
- Product Code: SSC-158748
-
Dehydroglyasperin D
- CAS RN: 517885-72-2
- Product Code: starshine_CAS517885-72-2
- Purity/Analytical method: >99.0%
