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CAS 6238-65-9 2-(2-FLUOROBENZOYL)PYRIDINE molecular structure lightbox
CAS RN: 6238-65-9

2-(2-FLUOROBENZOYL)PYRIDINE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260531 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS6238-65-9
  • Purity/Analytical Methods: >99.0%
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6238-65-9 / (2-fluorophenyl)-pyridin-2-ylmethanone

Standard CAS: 6238-65-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
6238-65-9
Multi CAS
No
Molecular Formula
C12FH8NO
Molecular Weight
201.200000
Exact Mass
201.058992
InChI
InChI=1S/C12H8FNO/c13-10-6-2-1-5-9(10)12(15)11-7-3-4-8-14-11/h1-8H
InChIKey
NXJUUEIQHLXBPZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
12
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
54.07
TPSA
29.96

LogP / Solubility

WLOGP
2.45
MLOGP
2.16
XLogP3
2
Consensus LogP
2.2
Log S (ESOL)
-3.09
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.98
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.24
Class (SILICOS-IT)
Poorly 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)
-2.21

Drug-likeness / Medicinal Chemistry

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

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