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CAS 34177-25-8 4-iodo-1,1′:3′,1”-terphenyl molecular structure lightbox
CAS RN: 34177-25-8

4-iodo-1,1′:3′,1”-terphenyl

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251124 250mg / 1g / 5g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS34177-25-8
  • Purity/Analytical Methods: >99.0%
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34177-25-8 / 1-iodo-4-(3-phenylphenyl)benzene

Standard CAS: 34177-25-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
34177-25-8
Multi CAS
No
Molecular Formula
C18H13I
Molecular Weight
356.200000
Exact Mass
356.006200
InChI
InChI=1S/C18H13I/c19-18-11-9-15(10-12-18)17-8-4-7-16(13-17)14-5-2-1-3-6-14/h1-13H
InChIKey
OULKUTIENOGKKJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
18
Rotatable bonds
2
Molar refractivity
90.03
TPSA
0.0000

LogP / Solubility

WLOGP
5.63
MLOGP
4.97
XLogP3
5.8
Consensus LogP
5.47
Log S (ESOL)
-6.16
Class (ESOL)
Insoluble
Log S (Ali)
-6.54
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.88
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.9

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
1.5

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