CAS RN: 444315-17-7
PSS-(3-GLYCIDYL)PROPOXY-HEPTAISOBUTYL S&
Product Availability
Available package options are listed below.
1 package records1 with current stock
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250615 | 1g / 5g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS444315-17-7
- Purity/Analytical Methods: >99.0%
444315-17-7 / 1,3,5,7,9,11,13-heptakis(2-methylpropyl)-15-[3-(oxiran-2-ylmethoxy)propyl]-2,4,6,8,10,12,14,16,17,18,19,20-dodecaoxa-1,3,5,7,9,11,13,15-octasilapentacyclo[9.5.1.13,9.15,15.17,13]icosane
Basic Information
CAS
444315-17-7
Multi CAS
Yes
Molecular Formula
C34H74O14Si8
Molecular Weight
931.600000
Exact Mass
930.323269
InChI
InChI=1S/C34H74O14Si8/c1-27(2)20-50-37-49(17-15-16-35-18-34-19-36-34)38-51(21-28(3)4)42-53(40-50,23-30(7)8)46-56(26-33(13)14)47-54(41-50,24-31(9)10)43-52(39-49,22-29(5)6)45-55(44-51,48-56)25-32(11)12/h27-34H,15-26H2,1-14H3
InChIKey
GYEWKQMKBZAVJX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
56
Fraction Csp3
1
Rotatable bonds
20
H-bond acceptors
14
Molar refractivity
226.55
TPSA
132.52
LogP / Solubility
WLOGP
8.16
MLOGP
7.27
XLogP3
8.16
Consensus LogP
7.86
Log S (ESOL)
-9.44
Class (ESOL)
Insoluble
Log S (Ali)
-13.09
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-14.89
Class (SILICOS-IT)
Insoluble
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
Yes
Log Kp (skin permeation)
-2.61
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
10
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