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CAS 4394-00-7 Niflumic Acid molecular structure lightbox
CAS RN: 4394-00-7

Niflumic Acid

Product Availability

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8 package records8 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250409 100g In stock Shanghai Inquiry
Batchno.20250615 1g In stock Shanghai Inquiry
Batchno.20250601 1g / 5g / 25g / 100g Confirm by inquiry Shandong, Guangdong, Hebei, Shanghai Inquiry
Batchno.20260622 1mg In stock Shanghai, Wuhan Inquiry
Batchno.20251122 25g In stock Shanghai Inquiry
Batchno.20260508 25mg In stock Shanghai, Wuhan Inquiry
Batchno.20250123 5g In stock Shanghai, Shenzhen Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260222 1ml In stock Inquiry
  • Product code: SSC-152004
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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: 100g
  • Available purity: ≥98%
  • 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 4394-00-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥98% 0 Out of Stock Shenzhen Inquiry

4394-00-7 / 2-[3-(trifluoromethyl)anilino]pyridine-3-carboxylic acid

Standard CAS: 4394-00-7 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
4394-00-7
Multi CAS
Yes
Molecular Formula
C13F3H9N2O2
Molecular Weight
282.220000
Exact Mass
282.061612
InChI
InChI=1S/C13H9F3N2O2/c14-13(15,16)8-3-1-4-9(7-8)18-11-10(12(19)20)5-2-6-17-11/h1-7H,(H,17,18)(H,19,20)
InChIKey
JZFPYUNJRRFVQU-UHFFFAOYSA-N

Physical Properties

Melting Point
203 °C
Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.08
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
65.92
TPSA
62.22

LogP / Solubility

WLOGP
3.54
MLOGP
3.13
XLogP3
3.7
Consensus LogP
3.46
Log S (ESOL)
-4.07
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.43
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.79
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.93

Drug-likeness / Medicinal Chemistry

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

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