CAS RN: 65352-95-6
4-Pyridinecarbonyl chloride, 2-fluoro- (9CI)
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260519 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS65352-95-6
- Purity/Analytical Methods: >99.0%
65352-95-6 / 2-fluoropyridine-4-carbonyl chloride
Basic Information
CAS
65352-95-6
Multi CAS
No
Molecular Formula
C6H3CLFNO
Molecular Weight
159.540000
Exact Mass
158.988720
InChI
InChI=1S/C6H3ClFNO/c7-6(10)4-1-2-9-5(8)3-4/h1-3H
InChIKey
BWRHCKQYCOWAAV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
34.38
TPSA
29.96
LogP / Solubility
WLOGP
1.6
MLOGP
1.4
XLogP3
1.8
Consensus LogP
1.6
Log S (ESOL)
-2.22
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.02
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.14
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.56
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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![CAS 65355-36-4 [trans(trans)]-4′-pentyl[1,1′-bicyclohexyl]-4-carbonitrile molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/65355-36-4.gif)
