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CAS 34042-85-8 sudoxicam molecular structure lightbox
CAS RN: 34042-85-8

sudoxicam

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251126 5mg / 25mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS34042-85-8
  • Purity/Analytical Methods: >99.0%
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34042-85-8 / 4-hydroxy-2-methyl-1,1-dioxo-N-(1,3-thiazol-2-yl)-1lambda6,2-benzothiazine-3-carboxamide

Standard CAS: 34042-85-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
34042-85-8
Multi CAS
No
Molecular Formula
C13H11N3O4S2
Molecular Weight
337.400000
Exact Mass
337.019098
InChI
InChI=1S/C13H11N3O4S2/c1-16-10(12(18)15-13-14-6-7-21-13)11(17)8-4-2-3-5-9(8)22(16,19)20/h2-7,17H,1H3,(H,14,15,18)
InChIKey
SYCHUQUJURZQMO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
11
Fraction Csp3
0.08
Rotatable bonds
2
H-bond acceptors
6
H-bond donors
2
Molar refractivity
81.68
TPSA
99.6

LogP / Solubility

WLOGP
1.64
MLOGP
1.46
XLogP3
1.6
Consensus LogP
1.57
Log S (ESOL)
-3.2
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.51
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.46
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.61

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5

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