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CAS 1167056-17-8 4-Chloro pyrazolo[1,5-a]pyridine-3-carboxylic acid molecular structure lightbox
CAS RN: 1167056-17-8

4-Chloro pyrazolo[1,5-a]pyridine-3-carboxylic acid

  • Product code: SSC-016650
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1167056-17-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

1167056-17-8 / 4-chloropyrazolo[1,5-a]pyridine-3-carboxylic acid

4-Chloropyrazolo[1,5-a]pyridine-3-carboxylic acid | MFCD12405123 | 4-Chloro pyrazolo[1,5-a]pyridine-3-carboxylic acid

Standard CAS: 1167056-17-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1167056-17-8
Multi CAS
No
Molecular Formula
C8H5ClN2O2
Molecular Weight
196.590000
Exact Mass
196.003955
SMILES
C1=CN2C(=C(C=N2)C(=O)O)C(=C1)Cl
InChI
InChI=1S/C8H5ClN2O2/c9-6-2-1-3-11-7(6)5(4-10-11)8(12)13/h1-4H,(H,12,13)
InChIKey
DQRAKKBKMSWGGH-UHFFFAOYSA-N
Synonyms
4-Chloropyrazolo[1,5-a]pyridine-3-carboxylic acid MFCD12405123 4-Chloro pyrazolo[1,5-a]pyridine-3-carboxylic acid 4-Chloropyrazolo[1,5-a]pyridine-3-carboxylicacid Pyrazolo[1,5-a]pyridine-3-carboxylic acid, 4-chloro-

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
47.16
TPSA
54.6

LogP / Solubility

WLOGP
1.69
MLOGP
1.48
XLogP3
1.2
Consensus LogP
1.46
Log S (ESOL)
-2.57
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.39
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.46
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)
-2.72

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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