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CAS 35592-26-8 4-aMino-2,5,6-trichloropyridine-3-carboxylic acid molecular structure lightbox
CAS RN: 35592-26-8

4-aMino-2,5,6-trichloropyridine-3-carboxylic acid

  • Product code: SSC-142613
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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 35592-26-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

35592-26-8 / 4-amino-2,5,6-trichloropyridine-3-carboxylic acid

Standard CAS: 35592-26-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
35592-26-8
Multi CAS
No
Molecular Formula
C6H3CL3N2O2
Molecular Weight
241.500000
Exact Mass
239.926010
InChI
InChI=1S/C6H3Cl3N2O2/c7-2-3(10)1(6(12)13)4(8)11-5(2)9/h(H2,10,11)(H,12,13)
InChIKey
XNACGDGWQLTXSO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
50.64
TPSA
76.21

LogP / Solubility

WLOGP
2.32
MLOGP
2.05
XLogP3
2.8
Consensus LogP
2.39
Log S (ESOL)
-3.08
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.22
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.28
Class (SILICOS-IT)
Poorly 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)
-2.54

Drug-likeness / Medicinal Chemistry

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

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