CAS RN: 865156-71-4
5-broMo-2-Methoxy-3-(3-Methoxypropoxy)pyridine
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251126 | 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS865156-71-4
- Purity/Analytical Methods: >99.0%
865156-71-4 / 5-bromo-2-methoxy-3-(3-methoxypropoxy)pyridine
Basic Information
CAS
865156-71-4
Multi CAS
No
Molecular Formula
BC10H14O3Rn
Molecular Weight
276.130000
Exact Mass
275.015710
InChI
InChI=1S/C10H14BrNO3/c1-13-4-3-5-15-9-6-8(11)7-12-10(9)14-2/h6-7H,3-5H2,1-2H3
InChIKey
LEDCNNBKVQRVBL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
6
H-bond acceptors
4
Molar refractivity
60.48
TPSA
40.58
LogP / Solubility
WLOGP
2.27
MLOGP
2
XLogP3
2
Consensus LogP
2.09
Log S (ESOL)
-2.88
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.46
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.06
Class (SILICOS-IT)
Slightly 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)
-2.79
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
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