[email protected]
CAS 52090-78-5 3-broMo-5-Methyl-1H-pyrazolo[4,3-b]pyridine molecular structure lightbox
CAS RN: 52090-78-5

3-broMo-5-Methyl-1H-pyrazolo[4,3-b]pyridine

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260108 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS52090-78-5
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

52090-78-5 / 3-bromo-5-methyl-2H-pyrazolo[4,3-b]pyridine

Standard CAS: 52090-78-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
52090-78-5
Multi CAS
No
Molecular Formula
BC7H6Rn3
Molecular Weight
212.050000
Exact Mass
210.974510
InChI
InChI=1S/C7H6BrN3/c1-4-2-3-5-6(9-4)7(8)11-10-5/h2-3H,1H3,(H,10,11)
InChIKey
NOMFNCPFEGECCQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.14
H-bond acceptors
2
H-bond donors
1
Molar refractivity
46.33
TPSA
41.57

LogP / Solubility

WLOGP
2.03
MLOGP
1.79
XLogP3
2
Consensus LogP
1.94
Log S (ESOL)
-3.04
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.76
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.72
Class (SILICOS-IT)
Moderately 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)
-2.57

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us