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CAS 7675-04-9 5,6-Dihydro-4H-thieno[2,3-b]thiopyran-4-one molecular structure lightbox
CAS RN: 7675-04-9

5,6-Dihydro-4H-thieno[2,3-b]thiopyran-4-one

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250610 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS7675-04-9
  • Purity/Analytical Methods: >99.0%
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7675-04-9 / 5,6-dihydrothieno[2,3-b]thiopyran-4-one

Standard CAS: 7675-04-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
7675-04-9
Multi CAS
No
Molecular Formula
C7H6OS2
Molecular Weight
170.300000
Exact Mass
169.986007
InChI
InChI=1S/C7H6OS2/c8-6-2-4-10-7-5(6)1-3-9-7/h1,3H,2,4H2
InChIKey
QHIWYFNTGCSHTG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.29
H-bond acceptors
3
Molar refractivity
43.99
TPSA
17.07

LogP / Solubility

WLOGP
2.43
MLOGP
2.13
XLogP3
1.9
Consensus LogP
2.15
Log S (ESOL)
-2.79
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.71
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.78
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)
-2.04

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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