![CAS 17782-81-9 Imidazo[2,1-b]thiazole-5-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/17782-81-9.gif)
CAS RN: 17782-81-9
Imidazo[2,1-b]thiazole-5-carboxylic acid
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260513 | 25mg / 100mg / 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS17782-81-9
- Purity/Analytical Methods: >99.0%
17782-81-9 / imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
Basic Information
CAS
17782-81-9
Multi CAS
No
Molecular Formula
C6H4N2O2S
Molecular Weight
168.180000
Exact Mass
167.999349
SMILES
C1=CSC2=NC=C(N21)C(=O)O
InChI
InChI=1S/C6H4N2O2S/c9-5(10)4-3-7-6-8(4)1-2-11-6/h1-3H,(H,9,10)
InChIKey
ZGIABSKPSCMXFD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
8
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
40.03
TPSA
54.6
LogP / Solubility
WLOGP
1.09
MLOGP
0.96
XLogP3
1.7
Consensus LogP
1.25
Log S (ESOL)
-2.04
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.73
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.78
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)
-2.97
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
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