CAS RN: 675590-26-8

3-BROMO-5-(3-CHLOROPHENYL)-PYRIDINE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260309 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS675590-26-8
  • Purity/Analytical Methods: >99.0%
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675590-26-8 / 3-bromo-5-(3-chlorophenyl)pyridine

Standard CAS: 675590-26-8 Multi CAS: No

Basic Information

CAS
675590-26-8
Multi CAS
No
Molecular Formula
C11H7BRCLN
Molecular Weight
268.530000
Exact Mass
266.945040
InChI
InChI=1S/C11H7BrClN/c12-10-4-9(6-14-7-10)8-2-1-3-11(13)5-8/h1-7H
InChIKey
YEFLJKWCTTZYOE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
12
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
62.38
TPSA
12.89

LogP / Solubility

WLOGP
4.16
MLOGP
3.67
XLogP3
3.8
Consensus LogP
3.88
Log S (ESOL)
-4.7
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.77
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.98
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.4

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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