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CAS 933707-83-6 6-methylimidazo[2,1-b][1,3]thiazole-3-carboxylic acid(SALTDATA: HCl) molecular structure lightbox
CAS RN: 933707-83-6

6-methylimidazo[2,1-b][1,3]thiazole-3-carboxylic acid(SALTDATA: HCl)

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Batchno.20260221 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS933707-83-6
  • Purity/Analytical Methods: >99.0%
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933707-83-6 / 6-methylimidazo[2,1-b][1,3]thiazole-3-carboxylic acid

Standard CAS: 933707-83-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
933707-83-6
Multi CAS
Yes
Molecular Formula
C7H6N2O2S
Molecular Weight
182.200000
Exact Mass
182.014999
InChI
InChI=1S/C7H6N2O2S/c1-4-2-9-5(6(10)11)3-12-7(9)8-4/h2-3H,1H3,(H,10,11)
InChIKey
PEGMBMPPBPZZPS-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
8
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
44.77
TPSA
54.6

LogP / Solubility

WLOGP
1.4
MLOGP
1.23
XLogP3
2.1
Consensus LogP
1.58
Log S (ESOL)
-2.28
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.07
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.13
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)
-2.84

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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