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CAS 14527-46-9 5-NITRO-1,3-THIAZOLE 96 molecular structure lightbox
CAS RN: 14527-46-9

5-NITRO-1,3-THIAZOLE 96

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250919 100mg In stock Shanghai Inquiry
Batchno.20260216 1g In stock Shanghai Inquiry
Batchno.20250221 250mg In stock Shanghai Inquiry
Batchno.20250922 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
Batchno.20250614 5g In stock Shanghai Inquiry
  • Product code: SSC-056614
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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: ＞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 14527-46-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

14527-46-9 / 5-nitro-1,3-thiazole

Standard CAS: 14527-46-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
14527-46-9
Multi CAS
No
Molecular Formula
C3H2N2O2S
Molecular Weight
130.130000
Exact Mass
129.983698
SMILES
C1=C(SC=N1)[N+](=O)[O-]
InChI
InChI=1S/C3H2N2O2S/c6-5(7)3-1-4-2-8-3/h1-2H
InChIKey
VVVCJCRUFSIVHI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
5
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
28.77
TPSA
56.03

LogP / Solubility

WLOGP
1.05
MLOGP
0.92
XLogP3
1.1
Consensus LogP
1.02
Log S (ESOL)
-1.71
Class (ESOL)
Soluble
Log S (Ali)
-1.39
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.5
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)
-2.77

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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