![CAS 864238-20-0 L-Phenylalanine, N-[(2R,3R)-3-methoxy-2-methyl-1-oxo-3-(2S)-2-pyrrolidinylpropyl]-, methyl ester, monohydrochloride (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/864238-20-0.gif)
CAS RN: 864238-20-0
L-Phenylalanine, N-[(2R,3R)-3-methoxy-2-methyl-1-oxo-3-(2S)-2-pyrrolidinylpropyl]-, methyl ester, monohydrochloride (9CI)
Product Availability
Choose a grade to view its available package options.
6 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260510 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260525 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20260115 | 10mg / 25mg | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20251012 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20251207 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20260515 | 50mg | In stock | Shanghai | Inquiry |
- Product code: SSC-195439
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: 0.25g
- Available purity: ＞97%
- 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 |
|---|---|---|---|---|
| 0.25g | ＞97% | 0 Out of Stock | Hong Kong | Inquiry |
864238-20-0 / methyl (2S)-2-[[(2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanoyl]amino]-3-phenylpropanoate;hydrochloride
Basic Information
CAS
864238-20-0
Multi CAS
Yes
Molecular Formula
C19H29CLN2O4
Molecular Weight
384.900000
Exact Mass
384.181585
InChI
InChI=1S/C19H28N2O4.ClH/c1-13(17(24-2)15-10-7-11-20-15)18(22)21-16(19(23)25-3)12-14-8-5-4-6-9-14;/h4-6,8-9,13,15-17,20H,7,10-12H2,1-3H3,(H,21,22);1H/t13-,15+,16+,17-;/m1./s1
InChIKey
IKNWSNCMBMHJAU-WOLLCHHQSA-N
Computed Properties
Structural Parameters
Heavy atom count
26
Aromatic heavy atom count
6
Fraction Csp3
0.58
Rotatable bonds
8
H-bond acceptors
5
H-bond donors
2
Molar refractivity
102.33
TPSA
76.66
LogP / Solubility
WLOGP
1.71
MLOGP
1.53
XLogP3
1.71
Consensus LogP
1.65
Log S (ESOL)
-2.95
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.95
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.54
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.85
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5
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