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CAS 73956-17-9 ETHYL-2-FORMYLTHIAZOLE-4-CARBOXYLATE molecular structure lightbox
CAS RN: 73956-17-9

ETHYL-2-FORMYLTHIAZOLE-4-CARBOXYLATE

  • Product code: SSC-183386
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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: 1g, 5g, 0.25g, 10g
  • Available purity: >97%
  • Inventory rows with stock: 4
  • 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 73956-17-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 4 In Stock Hong Kong Inquiry
5g >97% 3 In Stock Beijing Inquiry
0.25g >97% 2 In Stock Hong Kong Inquiry
10g >97% 1 In Stock Shenzhen Inquiry

73956-17-9 / ethyl 2-formyl-1,3-thiazole-4-carboxylate

Standard CAS: 73956-17-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
73956-17-9
Multi CAS
No
Molecular Formula
C7H7NO3S
Molecular Weight
185.200000
Exact Mass
185.014664
InChI
InChI=1S/C7H7NO3S/c1-2-11-7(10)5-4-12-6(3-9)8-5/h3-4H,2H2,1H3
InChIKey
YKOVJIFWXRQGNC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
5
Fraction Csp3
0.29
Rotatable bonds
3
H-bond acceptors
5
Molar refractivity
43.46
TPSA
56.26

LogP / Solubility

WLOGP
1.13
MLOGP
0.99
XLogP3
1.3
Consensus LogP
1.14
Log S (ESOL)
-1.81
Class (ESOL)
Soluble
Log S (Ali)
-1.9
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.16
Class (SILICOS-IT)
Moderately 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
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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