CAS RN: 1890909-02-0

1-Chloroimidazo[1,5-a]pyridine

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Batchno.20251027 50mg / 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1890909-02-0
  • Purity/Analytical Methods: >99.0%
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1890909-02-0 / 1-chloroimidazo[1,5-a]pyridine

Standard CAS: 1890909-02-0 Multi CAS: No

Basic Information

CAS
1890909-02-0
Multi CAS
No
Molecular Formula
C7H5ClN2
Molecular Weight
152.580000
Exact Mass
152.014126
SMILES
C1=CC2=C(N=CN2C=C1)Cl
InChI
InChI=1S/C7H5ClN2/c8-7-6-3-1-2-4-10(6)5-9-7/h1-5H
InChIKey
STBAANALDPCHLR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
9
H-bond acceptors
2
Molar refractivity
40.2
TPSA
17.3

LogP / Solubility

WLOGP
1.99
MLOGP
1.74
XLogP3
2.8
Consensus LogP
2.18
Log S (ESOL)
-2.7
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.25
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.3
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)
-2.24

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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