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CAS 1435806-00-0 Thiazole, 5-broMo-2-(1,3-dioxolan-2-yl)- molecular structure lightbox
CAS RN: 1435806-00-0

Thiazole, 5-broMo-2-(1,3-dioxolan-2-yl)-

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260528 100mg / 250mg / 500mg Out of stock 1 business days Inquiry
  • Product code: SSC-054975
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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 1435806-00-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

1435806-00-0 / 5-bromo-2-(1,3-dioxolan-2-yl)-1,3-thiazole

Standard CAS: 1435806-00-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1435806-00-0
Multi CAS
No
Molecular Formula
C6H6BrNO2S
Molecular Weight
236.090000
Exact Mass
234.930260
SMILES
C1COC(O1)C2=NC=C(S2)Br
InChI
InChI=1S/C6H6BrNO2S/c7-4-3-8-5(11-4)6-9-1-2-10-6/h3,6H,1-2H2
InChIKey
FUGHWGLCEYOMJY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
5
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
44.46
TPSA
31.35

LogP / Solubility

WLOGP
1.95
MLOGP
1.72
XLogP3
1.4
Consensus LogP
1.69
Log S (ESOL)
-2.8
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.9
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.93
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)
-2.77

Drug-likeness / Medicinal Chemistry

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

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