CAS RN: 500788-94-3
BOC-(R)-3-AMINO-3-(3,5-DIMETHOXY-PHENYL)-PROPIONIC ACID
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250603 | 50mg / 250mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: SSC-156437
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 | Hong Kong | Inquiry |
500788-94-3 / (3R)-3-(3,5-dimethoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Basic Information
CAS
500788-94-3
Multi CAS
Yes
Molecular Formula
C16H23NO6
Molecular Weight
325.360000
Exact Mass
325.152537
InChI
InChI=1S/C16H23NO6/c1-16(2,3)23-15(20)17-13(9-14(18)19)10-6-11(21-4)8-12(7-10)22-5/h6-8,13H,9H2,1-5H3,(H,17,20)(H,18,19)/t13-/m1/s1
InChIKey
DNLBKBXJRJCIAH-CYBMUJFWSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
6
H-bond acceptors
5
H-bond donors
2
Molar refractivity
83.91
TPSA
94.09
LogP / Solubility
WLOGP
2.74
MLOGP
2.43
XLogP3
1.9
Consensus LogP
2.36
Log S (ESOL)
-3.38
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.21
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.77
Class (SILICOS-IT)
Slightly 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)
-2.76
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3
Customers Also Viewed
-
BOC-(R)-3-AMINO-3-(3-PYRIDYL)-PROPIONIC ACID
- CAS RN: 500788-96-5
- Product Code: SSC-156438
-
BOC-(R)-3-AMINO-3-(3-THIENYL)-PROPIONIC ACID
- CAS RN: 500788-99-8
- Product Code: SSC-156439
-
BOC-(R)-3-AMINO-3-(1-NAPHTHYL)-PROPIONIC ACID
- CAS RN: 500789-00-4
- Product Code: SSC-156440
-
-
BOC-(R)-3-AMINO-3-(2-FLUORO-PHENYL)-PROPIONIC ACID
- CAS RN: 500789-03-7
- Product Code: starshine_CAS500789-03-7
- Purity/Analytical method: >99.0%
-
