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CAS 52538-09-7 2,3-Dimethyl-3H-imidazo[4,5-c]pyridine molecular structure lightbox
CAS RN: 52538-09-7

2,3-Dimethyl-3H-imidazo[4,5-c]pyridine

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250123 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: LIND900533
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52538-09-7 / 2,3-dimethylimidazo[4,5-c]pyridine

Standard CAS: 52538-09-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
52538-09-7
Multi CAS
No
Molecular Formula
C8H9N3
Molecular Weight
147.180000
Exact Mass
147.079647
InChI
InChI=1S/C8H9N3/c1-6-10-7-3-4-9-5-8(7)11(6)2/h3-5H,1-2H3
InChIKey
OWKNQTHLYPTZLP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.25
H-bond acceptors
3
Molar refractivity
43.25
TPSA
30.71

LogP / Solubility

WLOGP
1.28
MLOGP
1.12
XLogP3
0.8
Consensus LogP
1.07
Log S (ESOL)
-2.16
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.69
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.68
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.71

Drug-likeness / Medicinal Chemistry

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

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