CAS RN: 17065-99-5

3,8,11,14-TETRAOXA-2,4-DISILAPENTADECANE, 2,2,4,4-TETRAMETHYL-

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Batchno.20250915 1g / 5g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS17065-99-5
  • Purity/Analytical Methods: >99.0%
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17065-99-5 / 3-[2-(2-methoxyethoxy)ethoxy]propyl-dimethyl-trimethylsilyloxysilane

Standard CAS: 17065-99-5 Multi CAS: No

Basic Information

CAS
17065-99-5
Multi CAS
No
Molecular Formula
C13H32O4Si2
Molecular Weight
308.560000
Exact Mass
308.183913
SMILES
COCCOCCOCCC[Si](C)(C)O[Si](C)(C)C
InChI
InChI=1S/C13H32O4Si2/c1-14-9-10-16-12-11-15-8-7-13-19(5,6)17-18(2,3)4/h7-13H2,1-6H3
InChIKey
CBFCYAGKRBPSGN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Fraction Csp3
1
Rotatable bonds
12
H-bond acceptors
4
Molar refractivity
84.85
TPSA
36.92

LogP / Solubility

WLOGP
3.11
MLOGP
2.75
XLogP3
3.11
Consensus LogP
2.99
Log S (ESOL)
-2.92
Class (ESOL)
Moderately soluble
Log S (Ali)
-4.34
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.69
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.39

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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