[email protected]
CAS 1234615-90-7 5-CHLORO-7-METHYL-3H-IMIDAZO[4,5-B]PYRIDINE molecular structure lightbox
CAS RN: 1234615-90-7

5-CHLORO-7-METHYL-3H-IMIDAZO[4,5-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.20260527 500mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1234615-90-7
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1234615-90-7 / 5-chloro-7-methyl-1H-imidazo[4,5-b]pyridine

Standard CAS: 1234615-90-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1234615-90-7
Multi CAS
No
Molecular Formula
C7H6ClN3
Molecular Weight
167.590000
Exact Mass
167.025025
SMILES
CC1=CC(=NC2=C1NC=N2)Cl
InChI
InChI=1S/C7H6ClN3/c1-4-2-5(8)11-7-6(4)9-3-10-7/h2-3H,1H3,(H,9,10,11)
InChIKey
RXNPGJXAAMFJJW-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
43.64
TPSA
41.57

LogP / Solubility

WLOGP
1.92
MLOGP
1.69
XLogP3
2.1
Consensus LogP
1.9
Log S (ESOL)
-2.69
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.32
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.34
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.38

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us