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CAS 694433-59-5 SB-505124 molecular structure lightbox
CAS RN: 694433-59-5

SB-505124

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250719 100mg In stock Shanghai Inquiry
Batchno.20251104 10mg In stock Shanghai Inquiry
Batchno.20260426 1mg In stock Shanghai, Wuhan Inquiry
Batchno.20250710 250mg In stock Shanghai Inquiry
Batchno.20251224 25mg In stock Shanghai Inquiry
Batchno.20260531 50mg In stock Shanghai Inquiry
Batchno.20251228 5mg In stock Shanghai, Wuhan Inquiry
  • Product code: SSC-179131
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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: ≥98%
  • 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 694433-59-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥98% 0 Out of Stock Hong Kong Inquiry

694433-59-5 / 2-[4-(1,3-benzodioxol-5-yl)-2-tert-butyl-1H-imidazol-5-yl]-6-methylpyridine

Standard CAS: 694433-59-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
694433-59-5
Multi CAS
Yes
Molecular Formula
C20H21N3O2
Molecular Weight
335.400000
Exact Mass
335.163377
InChI
InChI=1S/C20H21N3O2/c1-12-6-5-7-14(21-12)18-17(22-19(23-18)20(2,3)4)13-8-9-15-16(10-13)25-11-24-15/h5-10H,11H2,1-4H3,(H,22,23)
InChIKey
WGZOTBUYUFBEPZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
17
Fraction Csp3
0.3
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
96.81
TPSA
60.03

LogP / Solubility

WLOGP
4.47
MLOGP
3.95
XLogP3
4.3
Consensus LogP
4.24
Log S (ESOL)
-5.11
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.54
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.79
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.59

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3

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