CAS RN: 28728-55-4
HEXADIMETHRINE BROMIDE
Product Availability
Choose a grade to view its available package options.
4 package records4 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250621 | 1g / 5g / 25g | Confirm by inquiry | Shanghai, Chongqing, Hebei | Inquiry |
- Product code: starshine_CAS28728-55-4
- Purity/Analytical Methods: >99.0%
28728-55-4 / 1,3-dibromopropane;N,N,N',N'-tetramethylhexane-1,6-diamine
Basic Information
CAS
28728-55-4
Multi CAS
Yes
Molecular Formula
C13H30Br2N2
Molecular Weight
374.200000
Exact Mass
374.075520
InChI
InChI=1S/C10H24N2.C3H6Br2/c1-11(2)9-7-5-6-8-10-12(3)4;4-2-1-3-5/h5-10H2,1-4H3;1-3H2
InChIKey
KZKAYEGOIJEWQB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Fraction Csp3
1
Rotatable bonds
9
H-bond acceptors
2
Molar refractivity
87.78
TPSA
6.48
LogP / Solubility
WLOGP
3.84
MLOGP
3.4
XLogP3
3.84
Consensus LogP
3.69
Log S (ESOL)
-3.98
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.4
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.36
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.28
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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