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CAS 69812-29-9 2-Acetamido-4-methylthiazole-5-sulfonyl Chloride molecular structure lightbox
CAS RN: 69812-29-9

2-Acetamido-4-methylthiazole-5-sulfonyl Chloride

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20251205 1g In stock Inquiry
Batchno.20260609 250mg In stock Inquiry
Batchno.20250319 5g In stock Inquiry
  • Product code: SSC-179586
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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: 5g
  • Available purity: ≥97%
  • 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 69812-29-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥97% 0 Out of Stock Hong Kong Inquiry

69812-29-9 / 2-acetamido-4-methyl-1,3-thiazole-5-sulfonyl chloride

Standard CAS: 69812-29-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
69812-29-9
Multi CAS
Yes
Molecular Formula
C6H7CLN2O3S2
Molecular Weight
254.700000
Exact Mass
253.958662
InChI
InChI=1S/C6H7ClN2O3S2/c1-3-5(14(7,11)12)13-6(8-3)9-4(2)10/h1-2H3,(H,8,9,10)
InChIKey
NXGKPRKPUCSEIL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
5
Fraction Csp3
0.33
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
1
Molar refractivity
54.19
TPSA
76.13

LogP / Solubility

WLOGP
1.34
MLOGP
1.18
XLogP3
1.2
Consensus LogP
1.24
Log S (ESOL)
-2.39
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.61
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.67
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.32

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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