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CAS 52454-63-4 1,3-THIAZOL-5-YLACETIC ACID molecular structure lightbox
CAS RN: 52454-63-4

1,3-THIAZOL-5-YLACETIC ACID

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250811 1g Out of stock 15 business days Inquiry
  • Product code: SSC-159562
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g
  • Available purity: >95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 52454-63-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 5 In Stock Shanghai Inquiry
0.25g >95% 3 In Stock Shenzhen Inquiry
1g >95% 2 In Stock Shenzhen Inquiry

52454-63-4 / 2-(1,3-thiazol-5-yl)acetic acid

Standard CAS: 52454-63-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
52454-63-4
Multi CAS
No
Molecular Formula
C5H5NO2S
Molecular Weight
143.170000
Exact Mass
143.004100
InChI
InChI=1S/C5H5NO2S/c7-5(8)1-4-2-6-3-9-4/h2-3H,1H2,(H,7,8)
InChIKey
KOQNISNMBYPFKQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
5
Fraction Csp3
0.2
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
33.45
TPSA
50.19

LogP / Solubility

WLOGP
0.77
MLOGP
0.67
XLogP3
0.5
Consensus LogP
0.65
Log S (ESOL)
-1.49
Class (ESOL)
Soluble
Log S (Ali)
-1.29
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.47
Class (SILICOS-IT)
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)
-3.05

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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