CAS RN: 81154-14-5

4-Thiazolidinone, 5-[(4-hydroxyphenyl)methylene]-2-thioxo-, (5Z)-

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5 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250426 100mg Out of stock Inquiry
Batchno.20250301 100mg / 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
Batchno.20260303 1g In stock Shenzhen Inquiry
Batchno.20251004 250mg In stock Shanghai, Tianjin Inquiry
Batchno.20251206 5g In stock Shenzhen Inquiry
  • Product code: starshine_CAS81154-14-5
  • Purity/Analytical Methods: >99.0%
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81154-14-5 / (5E)-5-[(4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Standard CAS: 81154-14-5 Multi CAS: Yes

Basic Information

CAS
81154-14-5
Multi CAS
Yes
Molecular Formula
C10H7NO2S2
Molecular Weight
237.300000
Exact Mass
236.991821
InChI
InChI=1S/C10H7NO2S2/c12-7-3-1-6(2-4-7)5-8-9(13)11-10(14)15-8/h1-5,12H,(H,11,13,14)/b8-5+
InChIKey
RAYIDZVPIAJJPF-VMPITWQZSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
64.42
TPSA
49.33

LogP / Solubility

WLOGP
1.88
MLOGP
1.66
XLogP3
2.4
Consensus LogP
1.98
Log S (ESOL)
-2.73
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.86
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.88
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)
-2.83

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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