CAS RN: 69214-12-6

3,5-DibroMoiMidazo[1,2-a]pyridine

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Batchno.20260626 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS69214-12-6
  • Purity/Analytical Methods: >99.0%
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69214-12-6 / 3,5-dibromoimidazo[1,2-a]pyridine

Standard CAS: 69214-12-6 Multi CAS: No

Basic Information

CAS
69214-12-6
Multi CAS
No
Molecular Formula
C7H4BR2N2
Molecular Weight
275.930000
Exact Mass
275.872070
InChI
InChI=1S/C7H4Br2N2/c8-5-2-1-3-7-10-4-6(9)11(5)7/h1-4H
InChIKey
RFQPNKYBAYTNOB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
2
Molar refractivity
50.59
TPSA
17.3

LogP / Solubility

WLOGP
2.86
MLOGP
2.53
XLogP3
3.8
Consensus LogP
3.06
Log S (ESOL)
-3.96
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.89
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.83
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.37

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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