CAS RN: 934826-68-3

SKQ1 Bromide

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6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260426 100mg In stock Shanghai Inquiry
Batchno.20251114 1g In stock Shanghai Inquiry
Batchno.20260421 250mg In stock Shanghai Inquiry
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Batchno.20260419 50mg In stock Shanghai Inquiry
Batchno.20250518 5mg / 10mg / 25mg / 100mg Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: starshine_CAS934826-68-3
  • Purity/Analytical Methods: >99.0%
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934826-68-3 / 10-(4,5-dimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)decyl-triphenylphosphanium bromide

Standard CAS: 934826-68-3 Multi CAS: No

Basic Information

CAS
934826-68-3
Multi CAS
No
Molecular Formula
C36H42BRO2P
Molecular Weight
617.600000
Exact Mass
616.210580
InChI
InChI=1S/C36H42O2P.BrH/c1-29-30(2)36(38)31(28-35(29)37)20-12-7-5-3-4-6-8-19-27-39(32-21-13-9-14-22-32,33-23-15-10-16-24-33)34-25-17-11-18-26-34;/h9-11,13-18,21-26,28H,3-8,12,19-20,27H2,1-2H3;1H/q+1;/p-1
InChIKey
WYHFWTRUGAFNKW-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
40
Aromatic heavy atom count
18
Fraction Csp3
0.33
Rotatable bonds
14
H-bond acceptors
2
Molar refractivity
168.04
TPSA
34.14

LogP / Solubility

WLOGP
4.91
MLOGP
4.37
XLogP3
4.91
Consensus LogP
4.73
Log S (ESOL)
-6.17
Class (ESOL)
Insoluble
Log S (Ali)
-8.17
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.43
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4.5

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