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CAS 1206250-69-2 2-BroMothiazolo[5,4-c]pyridine molecular structure lightbox
CAS RN: 1206250-69-2

2-BroMothiazolo[5,4-c]pyridine

  • Product code: SSC-021683
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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 1206250-69-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1206250-69-2 / 2-bromo-[1,3]thiazolo[5,4-c]pyridine

2-Bromothiazolo[5,4-c]pyridine | MFCD14581889 | 2-BROMO-[1,3]THIAZOLO[5,4-C]PYRIDINE

Standard CAS: 1206250-69-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1206250-69-2
Multi CAS
No
Molecular Formula
C6H3BrN2S
Molecular Weight
215.070000
Exact Mass
213.920030
SMILES
C1=CN=CC2=C1N=C(S2)Br
InChI
InChI=1S/C6H3BrN2S/c7-6-9-4-1-2-8-3-5(4)10-6/h1-3H
InChIKey
ZEWXPIQOBBIVPE-UHFFFAOYSA-N
Synonyms
2-Bromothiazolo[5,4-c]pyridine MFCD14581889 2-BROMO-[1,3]THIAZOLO[5,4-C]PYRIDINE PB48101 PS-15727

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
9
H-bond acceptors
3
Molar refractivity
45.12
TPSA
25.78

LogP / Solubility

WLOGP
2.45
MLOGP
2.16
XLogP3
2.3
Consensus LogP
2.3
Log S (ESOL)
-3.39
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.1
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.09
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.29

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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