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CAS 1140239-94-6 1H-Pyrazolo[4,3-c]pyridine-4-carboxylic acid molecular structure lightbox
CAS RN: 1140239-94-6

1H-Pyrazolo[4,3-c]pyridine-4-carboxylic acid

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260303 50mg / 100mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS1140239-94-6
  • Purity/Analytical Methods: >99.0%
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1140239-94-6 / 1H-pyrazolo[4,5-c]pyridine-4-carboxylic acid

1H-PYRAZOLO[4,3-C]PYRIDINE-4-CARBOXYLIC ACID | MFCD11870059 | 2H-PYRAZOLO[4,3-C]PYRIDINE-4-CARBOXYLIC ACID

Standard CAS: 1140239-94-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1140239-94-6
Multi CAS
No
Molecular Formula
C7H5N3O2
Molecular Weight
163.130000
Exact Mass
163.038176
SMILES
C1=CN=C(C2=C1NN=C2)C(=O)O
InChI
InChI=1S/C7H5N3O2/c11-7(12)6-4-3-9-10-5(4)1-2-8-6/h1-3H,(H,9,10)(H,11,12)
InChIKey
YSUDAYYNGUNFQN-UHFFFAOYSA-N
Synonyms
1H-PYRAZOLO[4,3-C]PYRIDINE-4-CARBOXYLIC ACID MFCD11870059 2H-PYRAZOLO[4,3-C]PYRIDINE-4-CARBOXYLIC ACID SCHEMBL17159725 SCHEMBL17159727

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
40.85
TPSA
78.87

LogP / Solubility

WLOGP
0.66
MLOGP
0.57
XLogP3
0.3
Consensus LogP
0.51
Log S (ESOL)
-1.75
Class (ESOL)
Soluble
Log S (Ali)
-1.37
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.38
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)
-3.25

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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