.gif)
CAS RN: 100157-53-7
(2S,3R)-Methyl 2-(((benzyloxy)carbonyl)aMino)-3-hydroxybutanoate
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.20250520 | 1g / 5g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-000556
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 1g, 5g, 10g, 100g, 25g, 0.1g, 0.25g
- Available purity: >95%
- Inventory rows with stock: 7
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | >95% | 5 In Stock | Shenzhen | Inquiry |
| 5g | >95% | 5 In Stock | Shanghai | Inquiry |
| 10g | >95% | 5 In Stock | Beijing | Inquiry |
| 100g | >95% | 5 In Stock | Shanghai | Inquiry |
| 25g | >95% | 4 In Stock | Shenzhen | Inquiry |
| 0.1g | >95% | 3 In Stock | Shenzhen | Inquiry |
| 0.25g | >95% | 3 In Stock | Shenzhen | Inquiry |
100157-53-7 / methyl (2R,3R)-3-hydroxy-2-(phenylmethoxycarbonylamino)butanoate
methyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxybutanoate | Z-L-Threonine methyl ester | (2S,3R)-Methyl 2-(((benzyloxy)carbonyl)amino)-3-hydroxybutanoate
Basic Information
CAS
100157-53-7
Multi CAS
Yes
Molecular Formula
C13H17NO5
Molecular Weight
267.280000
Exact Mass
267.110673
SMILES
C[C@H]([C@H](C(=O)OC)NC(=O)OCC1=CC=CC=C1)O
InChI
InChI=1S/C13H17NO5/c1-9(15)11(12(16)18-2)14-13(17)19-8-10-6-4-3-5-7-10/h3-7,9,11,15H,8H2,1-2H3,(H,14,17)/t9-,11-/m1/s1
InChIKey
OPZWAOJFQFYYIX-MWLCHTKSSA-N
Synonyms
methyl 2-{[(benzyloxy)carbonyl]amino}-3-hydroxybutanoate
Z-L-Threonine methyl ester
(2S,3R)-Methyl 2-(((benzyloxy)carbonyl)amino)-3-hydroxybutanoate
NSC287509
methyl 3-hydroxy-2-(phenylmethoxycarbonylamino)butanoate
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.38
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
2
Molar refractivity
67.25
TPSA
84.86
LogP / Solubility
WLOGP
0.84
MLOGP
0.74
XLogP3
1.1
Consensus LogP
0.89
Log S (ESOL)
-1.93
Class (ESOL)
Soluble
Log S (Ali)
-2.35
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.69
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)
-3.76
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5
Customers Also Viewed
-
-
ETHYL 2-METHYL-2-(1H-1,2,4-TRIAZOL-1-YL)PROPANOATE
- CAS RN: 100159-13-5
- Product Code: SSC-000558
-
GTTBUPHLSQKZEG-UHFFFAOYSA-M
- CAS RN: 100180-30-1
- Product Code: starshine_CAS100180-30-1
- Purity/Analytical method: >99.0%
-
-
2-(Methylthio)-5,6-dihydropyrimidin-4(1H)-one
- CAS RN: 100185-53-3
- Product Code: SSC-000591
-
4H-1-Benzopyran-4-one,2-[2,4-dihydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-5,7-dihydroxy-3-(3-methyl-2-buten-1-yl)-
- CAS RN: 100187-66-4
- Product Code: starshine_CAS100187-66-4
- Purity/Analytical method: >99.0%
.gif)
.gif)
![CAS 100187-66-4 4H-1-Benzopyran-4-one,2-[2,4-dihydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-5,7-dihydroxy-3-(3-methyl-2-buten-1-yl)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/100187-66-4.gif)