CAS RN: 67-30-1

3,3′,5,5′-Tetraiodothyroacetic Acid

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251201 100mg In stock Shanghai Inquiry
Batchno.20251107 1g Out of stock Inquiry
Batchno.20250508 250mg In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250829 25mg / 100mg / 500mg Confirm by inquiry Shanghai, Shandong 8-10 business days Inquiry
  • Product code: ICTT3730
  • Purity/Analytical Methods: >98.0%(HPLC)(N)
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67-30-1 / 2-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]acetic acid

Standard CAS: 67-30-1 Multi CAS: Yes

Basic Information

CAS
67-30-1
Multi CAS
Yes
Molecular Formula
C14H8I4O4
Molecular Weight
747.830000
Exact Mass
747.660100
InChI
InChI=1S/C14H8I4O4/c15-8-4-7(5-9(16)13(8)21)22-14-10(17)1-6(2-11(14)18)3-12(19)20/h1-2,4-5,21H,3H2,(H,19,20)
InChIKey
PPJYSSNKSXAVDB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
12
Fraction Csp3
0.07
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
2
Molar refractivity
116.83
TPSA
66.76

LogP / Solubility

WLOGP
5.23
MLOGP
4.67
XLogP3
5.2
Consensus LogP
5.03
Log S (ESOL)
-7.91
Class (ESOL)
Insoluble
Log S (Ali)
-9.47
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.34
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.57

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.56
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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