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CAS 352018-92-9 5-IODO-2-PHENOXYPYRIDINE molecular structure lightbox
CAS RN: 352018-92-9

5-IODO-2-PHENOXYPYRIDINE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260320 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS352018-92-9
  • Purity/Analytical Methods: >99.0%
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352018-92-9 / 5-iodo-2-phenoxypyridine

Standard CAS: 352018-92-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
352018-92-9
Multi CAS
No
Molecular Formula
C11H8InO
Molecular Weight
297.090000
Exact Mass
296.965060
InChI
InChI=1S/C11H8INO/c12-9-6-7-11(13-8-9)14-10-4-2-1-3-5-10/h1-8H
InChIKey
JCEXQQNAXWYXRX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
12
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
63.47
TPSA
22.12

LogP / Solubility

WLOGP
3.48
MLOGP
3.07
XLogP3
3
Consensus LogP
3.18
Log S (ESOL)
-4.38
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.51
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.72
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.06

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

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