CAS RN: 864079-63-0

2,2-Dimethyl-4,7,10,13-tetraoxa-2-silatetradecane

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  • Product code: starshine_CAS864079-63-0
  • Purity/Analytical Methods: >99.0%
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864079-63-0 / 2-[2-(2-methoxyethoxy)ethoxy]ethoxymethyl-trimethylsilane

Standard CAS: 864079-63-0 Multi CAS: No

Basic Information

CAS
864079-63-0
Multi CAS
No
Molecular Formula
C11H26O4Si
Molecular Weight
250.410000
Exact Mass
250.160036
InChI
InChI=1S/C11H26O4Si/c1-12-5-6-13-7-8-14-9-10-15-11-16(2,3)4/h5-11H2,1-4H3
InChIKey
GODCNMFABWHNNF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
1
Rotatable bonds
11
H-bond acceptors
4
Molar refractivity
67.68
TPSA
36.92

LogP / Solubility

WLOGP
1.56
MLOGP
1.38
XLogP3
1.56
Consensus LogP
1.5
Log S (ESOL)
-1.65
Class (ESOL)
Soluble
Log S (Ali)
-2.74
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.9
Class (SILICOS-IT)
Poorly 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)
-3.14

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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