CAS RN: 94483-64-4
AMYL 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSIDE
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20251129 |
250mg / 1g |
Out of stock |
8-10 business days | Inquiry |
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Product code:
starshine_CAS94483-64-4
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Purity/Analytical Methods:
>99.0%
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94483-64-4 / N-[4,5-dihydroxy-6-(hydroxymethyl)-2-pentoxyoxan-3-yl]acetamide
Standard CAS: 94483-64-4
Multi CAS: Yes
Basic Information
CAS
94483-64-4
Multi CAS
Yes
Molecular Formula
C13H25NO6
Molecular Weight
291.340000
Exact Mass
291.168188
InChI
InChI=1S/C13H25NO6/c1-3-4-5-6-19-13-10(14-8(2)16)12(18)11(17)9(7-15)20-13/h9-13,15,17-18H,3-7H2,1-2H3,(H,14,16)/t9-,10-,11-,12-,13-/m1/s1
InChIKey
TXAKGSVWAUXDOK-SYLRKERUSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Fraction Csp3
0.92
Rotatable bonds
7
H-bond acceptors
6
H-bond donors
4
Molar refractivity
70.84
TPSA
108.25
LogP / Solubility
WLOGP
-0.86
MLOGP
-0.75
XLogP3
-0.3
Consensus LogP
-0.64
Log S (ESOL)
-0.64
Class (ESOL)
Very soluble
Log S (Ali)
-1.33
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.68
Class (SILICOS-IT)
Soluble
ADME
GI absorption
Low
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)
-5.11
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
4