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CAS 5817-39-0 REVERSE T3 molecular structure lightbox
CAS RN: 5817-39-0

REVERSE T3

Product Availability

Choose a grade to view its available package options.

9 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251207 100mg Out of stock Inquiry
Batchno.20250425 10mg In stock Shanghai Inquiry
Batchno.20250522 250mg Out of stock Inquiry
Batchno.20250830 25mg In stock Shanghai Inquiry
Batchno.20250417 50mg In stock Shanghai Inquiry
Batchno.20260328 5mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250708 10mg In stock Shanghai, Hebei Inquiry
Batchno.20250322 50mg In stock Shanghai Inquiry
Batchno.20251211 5mg In stock Shanghai, Guangdong, Chongqing Inquiry
  • Product code: SSC-166399
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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: 0.1g
  • 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 5817-39-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Shanghai Inquiry

5817-39-0 / 2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3-iodophenyl]propanoic acid

Standard CAS: 5817-39-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
5817-39-0
Multi CAS
Yes
Molecular Formula
C15H12I3NO4
Molecular Weight
650.970000
Exact Mass
650.790100
InChI
InChI=1S/C15H12I3NO4/c16-9-3-7(4-12(19)15(21)22)1-2-13(9)23-8-5-10(17)14(20)11(18)6-8/h1-3,5-6,12,20H,4,19H2,(H,21,22)
InChIKey
HZCBWYNLGPIQRK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
12
Fraction Csp3
0.13
Rotatable bonds
5
H-bond acceptors
4
H-bond donors
3
Molar refractivity
112.09
TPSA
92.78

LogP / Solubility

WLOGP
3.95
MLOGP
3.53
XLogP3
1.7
Consensus LogP
3.06
Log S (ESOL)
-6.42
Class (ESOL)
Insoluble
Log S (Ali)
-7.75
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.77
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.88

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
3

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