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CAS 64383-28-4 Pyridazine, 3-chloro-6-(phenylthio)- molecular structure lightbox
CAS RN: 64383-28-4

Pyridazine, 3-chloro-6-(phenylthio)-

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250313 100mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS64383-28-4
  • Purity/Analytical Methods: >99.0%
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64383-28-4 / 3-chloro-6-phenylsulfanylpyridazine

Standard CAS: 64383-28-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
64383-28-4
Multi CAS
No
Molecular Formula
C10H7CLN2S
Molecular Weight
222.690000
Exact Mass
222.001847
InChI
InChI=1S/C10H7ClN2S/c11-9-6-7-10(13-12-9)14-8-4-2-1-3-5-8/h1-7H
InChIKey
YWAQJKFAFIKUCA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
12
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
57.61
TPSA
25.78

LogP / Solubility

WLOGP
3.28
MLOGP
2.89
XLogP3
3.2
Consensus LogP
3.12
Log S (ESOL)
-3.79
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.76
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.07
Class (SILICOS-IT)
Slightly 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)
-1.75

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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