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CAS 66074-00-8 1,2,5-Oxadiazole, 3,4-bis(phenylsulfonyl)-, 2-oxide molecular structure lightbox
CAS RN: 66074-00-8

1,2,5-Oxadiazole, 3,4-bis(phenylsulfonyl)-, 2-oxide

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251015 1g In stock Shanghai, Chengdu Inquiry
Batchno.20260413 250mg In stock Shanghai Inquiry
Batchno.20260107 5g In stock Shanghai Inquiry
  • Product code: SSC-175716
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g, 10g
  • Available purity: ≥95%
  • Inventory rows with stock: 1
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 66074-00-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 1 In Stock Beijing Inquiry
0.25g ≥95% 0 Out of Stock Hong Kong Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry
5g ≥95% 0 Out of Stock Shanghai Inquiry
10g ≥95% 0 Out of Stock Shanghai Inquiry

66074-00-8 / 3,4-bis(benzenesulfonyl)-2-oxido-1,2,5-oxadiazol-2-ium

Standard CAS: 66074-00-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
66074-00-8
Multi CAS
Yes
Molecular Formula
C14H10N2O6S2
Molecular Weight
366.400000
Exact Mass
365.998028
InChI
InChI=1S/C14H10N2O6S2/c17-16-14(24(20,21)12-9-5-2-6-10-12)13(15-22-16)23(18,19)11-7-3-1-4-8-11/h1-10H
InChIKey
PLIHJANRRMFJCC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
17
Rotatable bonds
4
H-bond acceptors
7
Molar refractivity
79.25
TPSA
121.25

LogP / Solubility

WLOGP
0.97
MLOGP
0.88
XLogP3
2.2
Consensus LogP
1.35
Log S (ESOL)
-2.99
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.27
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.33
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.26

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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