CAS RN: 1268252-59-0
Acetamide, 2-(1,1-dimethylethoxy)-N-methoxy-N-methyl-
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.20251130 | 1g / 5g / 25g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1268252-59-0
- Purity/Analytical Methods: >99.0%
1268252-59-0 / N-methoxy-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide
Basic Information
CAS
1268252-59-0
Multi CAS
No
Molecular Formula
C8H17NO3
Molecular Weight
175.230000
Exact Mass
175.120843
SMILES
CC(C)(C)OCC(=O)N(C)OC
InChI
InChI=1S/C8H17NO3/c1-8(2,3)12-6-7(10)9(4)11-5/h6H2,1-5H3
InChIKey
ATVGLPXECJLJBZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Fraction Csp3
0.88
Rotatable bonds
3
H-bond acceptors
3
Molar refractivity
45.48
TPSA
38.77
LogP / Solubility
WLOGP
0.82
MLOGP
0.72
XLogP3
0.6
Consensus LogP
0.71
Log S (ESOL)
-1.25
Class (ESOL)
Soluble
Log S (Ali)
-1.59
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.84
Class (SILICOS-IT)
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)
-3.21
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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