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CAS 99446-50-1 Dimethyl pyrazolo[1,5-a]pyridine-3,5-dicarboxylate molecular structure lightbox
CAS RN: 99446-50-1

Dimethyl pyrazolo[1,5-a]pyridine-3,5-dicarboxylate

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Batchno.20250904 50mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS99446-50-1
  • Purity/Analytical Methods: >99.0%
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99446-50-1 / dimethyl pyrazolo[1,5-a]pyridine-3,5-dicarboxylate

Standard CAS: 99446-50-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
99446-50-1
Multi CAS
No
Molecular Formula
C11H10N2O4
Molecular Weight
234.210000
Exact Mass
234.064057
InChI
InChI=1S/C11H10N2O4/c1-16-10(14)7-3-4-13-9(5-7)8(6-12-13)11(15)17-2/h3-6H,1-2H3
InChIKey
AKTLRCRBYHVTOK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
9
Fraction Csp3
0.18
Rotatable bonds
2
H-bond acceptors
6
Molar refractivity
57.87
TPSA
69.9

LogP / Solubility

WLOGP
0.91
MLOGP
0.8
XLogP3
0.8
Consensus LogP
0.84
Log S (ESOL)
-2.12
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.14
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.18
Class (SILICOS-IT)
Moderately 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)
-3.5

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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