CAS RN: 136092-75-6
(2S,3R)-2-((tert-butoxycarbonyl)(methyl)amino)-3-methoxybutanoic acid(WXC09799)
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20260512 |
100mg / 250mg / 1g |
Out of stock |
5-7 business days | Inquiry |
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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: 0.1g, 0.25g, 1g
- Available purity: >95%
- Inventory rows with stock: 3
- Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 136092-75-6
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 0.1g |
>95% |
2
In Stock
|
Hong Kong |
Inquiry |
| 0.25g |
>95% |
2
In Stock
|
Shenzhen |
Inquiry |
| 1g |
>95% |
2
In Stock
|
Shenzhen |
Inquiry |
136092-75-6 / (2S,3R)-3-methoxy-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]butanoic acid
Standard CAS: 136092-75-6
Multi CAS: No
Basic Information
CAS
136092-75-6
Multi CAS
No
Molecular Formula
C11H21NO5
Molecular Weight
247.290000
Exact Mass
247.141973
SMILES
C[C@H]([C@@H](C(=O)O)N(C)C(=O)OC(C)(C)C)OC
InChI
InChI=1S/C11H21NO5/c1-7(16-6)8(9(13)14)12(5)10(15)17-11(2,3)4/h7-8H,1-6H3,(H,13,14)/t7-,8+/m1/s1
InChIKey
GPOFBERDSRBKHN-SFYZADRCSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Fraction Csp3
0.82
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
1
Molar refractivity
61.89
TPSA
76.07
LogP / Solubility
WLOGP
1.34
MLOGP
1.19
XLogP3
1
Consensus LogP
1.18
Log S (ESOL)
-1.95
Class (ESOL)
Soluble
Log S (Ali)
-2.56
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.86
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.28
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5