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CAS 75532-25-1 Thieno[3,4-c]furan-1,3(4H,6H)-dione molecular structure lightbox
CAS RN: 75532-25-1

Thieno[3,4-c]furan-1,3(4H,6H)-dione

  • Product code: SSC-184990
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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: 0.25g
  • 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 75532-25-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Beijing Inquiry

75532-25-1 / 4,6-dihydrothieno[3,4-c]furan-1,3-dione

Standard CAS: 75532-25-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
75532-25-1
Multi CAS
No
Molecular Formula
C6H4O3S
Molecular Weight
156.160000
Exact Mass
155.988115
InChI
InChI=1S/C6H4O3S/c7-5-3-1-10-2-4(3)6(8)9-5/h1-2H2
InChIKey
OEPDMUMGYXMSJZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.33
H-bond acceptors
4
Molar refractivity
35.45
TPSA
43.37

LogP / Solubility

WLOGP
0.11
MLOGP
0.09
XLogP3
-0.1
Consensus LogP
0.03
Log S (ESOL)
-0.88
Class (ESOL)
Very soluble
Log S (Ali)
-0.92
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.77
Class (SILICOS-IT)
Very 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)
-3.59

Drug-likeness / Medicinal Chemistry

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

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