CAS RN: 37026-88-3
Tributylmethylammonium bromide
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250118 | 1g | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS37026-88-3
- Purity/Analytical Methods: >99.0%
37026-88-3 / tributyl(methyl)azanium bromide
Basic Information
CAS
37026-88-3
Multi CAS
Yes
Molecular Formula
BC13H30Rn
Molecular Weight
280.290000
Exact Mass
279.156160
InChI
InChI=1S/C13H30N.BrH/c1-5-8-11-14(4,12-9-6-2)13-10-7-3;/h5-13H2,1-4H3;1H/q+1;/p-1
InChIKey
DHAWHVVWUNNONG-UHFFFAOYSA-M
Computed Properties
Structural Parameters
Heavy atom count
15
Fraction Csp3
1
Rotatable bonds
9
H-bond acceptors
1
Molar refractivity
65.51
TPSA
0.0000
LogP / Solubility
WLOGP
0.84
MLOGP
0.75
XLogP3
0.84
Consensus LogP
0.81
Log S (ESOL)
-1.51
Class (ESOL)
Soluble
Log S (Ali)
-2.46
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.26
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)
-3.84
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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