[email protected]
CAS 1844-53-7 6-Chloro-2-phenylimidazo[1,2-b]pyridazine molecular structure lightbox
CAS RN: 1844-53-7

6-Chloro-2-phenylimidazo[1,2-b]pyridazine

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250510 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1844-53-7
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1844-53-7 / 6-chloro-2-phenylimidazo[1,2-b]pyridazine

Standard CAS: 1844-53-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1844-53-7
Multi CAS
No
Molecular Formula
C12H8ClN3
Molecular Weight
229.660000
Exact Mass
229.040675
SMILES
C1=CC=C(C=C1)C2=CN3C(=N2)C=CC(=N3)Cl
InChI
InChI=1S/C12H8ClN3/c13-11-6-7-12-14-10(8-16(12)15-11)9-4-2-1-3-5-9/h1-8H
InChIKey
FPWMERDSYDEJOP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
15
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
63.43
TPSA
30.19

LogP / Solubility

WLOGP
3.05
MLOGP
2.69
XLogP3
2.9
Consensus LogP
2.88
Log S (ESOL)
-3.81
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.65
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.8
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)
-1.96

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