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CAS 29947-24-8 2-Bromo-4,5-dimethyl-1,3-thiazole molecular structure lightbox
CAS RN: 29947-24-8

2-Bromo-4,5-dimethyl-1,3-thiazole

  • Product code: SSC-133370
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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 29947-24-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Beijing Inquiry

29947-24-8 / 2-bromo-4,5-dimethyl-1,3-thiazole

Standard CAS: 29947-24-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
29947-24-8
Multi CAS
No
Molecular Formula
BC5H6RnS
Molecular Weight
192.080000
Exact Mass
190.940430
InChI
InChI=1S/C5H6BrNS/c1-3-4(2)8-5(6)7-3/h1-2H3
InChIKey
SOFNZMRISCENSZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
5
Fraction Csp3
0.4
H-bond acceptors
2
Molar refractivity
39.29
TPSA
12.89

LogP / Solubility

WLOGP
2.52
MLOGP
2.22
XLogP3
2.8
Consensus LogP
2.51
Log S (ESOL)
-3.08
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.96
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3
Class (SILICOS-IT)
Poorly 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)
-2.1

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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