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CAS 89260-45-7 4-(1H-PYRAZOL-3-YL)ANILINE HYDROCHLORIDE molecular structure lightbox
CAS RN: 89260-45-7

4-(1H-PYRAZOL-3-YL)ANILINE HYDROCHLORIDE

Product Availability

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3 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251109 100mg Out of stock Inquiry
Batchno.20260518 250mg In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250529 20mg / 100mg Out of stock 15 business days Inquiry
  • Product code: SSC-201144
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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 89260-45-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

89260-45-7 / 4-(1H-pyrazol-5-yl)aniline

Standard CAS: 89260-45-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
89260-45-7
Multi CAS
Yes
Molecular Formula
C9H9N3
Molecular Weight
159.190000
Exact Mass
159.079647
InChI
InChI=1S/C9H9N3/c10-8-3-1-7(2-4-8)9-5-6-11-12-9/h1-6H,10H2,(H,11,12)
InChIKey
WGZDTRWVJYXEFO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
11
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
48.44
TPSA
54.7

LogP / Solubility

WLOGP
1.66
MLOGP
1.45
XLogP3
1.2
Consensus LogP
1.44
Log S (ESOL)
-2.48
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.06
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.19
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)
-2.51

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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