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CAS 89-29-2 3-Methyl-1-(3′-sulfoamidophenyl)-5-pyrazolone molecular structure lightbox
CAS RN: 89-29-2

3-Methyl-1-(3′-sulfoamidophenyl)-5-pyrazolone

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250422 5g In stock Shanghai, Shandong, Hebei Inquiry
  • Product code: SSC-200787
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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: 25g
  • 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 89-29-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥95% 0 Out of Stock Shenzhen Inquiry

89-29-2 / 3-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonamide

Standard CAS: 89-29-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
89-29-2
Multi CAS
Yes
Molecular Formula
C10H11N3O3S
Molecular Weight
253.280000
Exact Mass
253.052112
InChI
InChI=1S/C10H11N3O3S/c1-7-5-10(14)13(12-7)8-3-2-4-9(6-8)17(11,15)16/h2-4,6H,5H2,1H3,(H2,11,15,16)
InChIKey
ASVVGQURNHNITH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.2
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
63.03
TPSA
92.83

LogP / Solubility

WLOGP
0.45
MLOGP
0.4
XLogP3
-0.2
Consensus LogP
0.22
Log S (ESOL)
-1.82
Class (ESOL)
Soluble
Log S (Ali)
-1.96
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.92
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.95

Drug-likeness / Medicinal Chemistry

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

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