CAS RN: 207994-10-3
5-chloro-3-fluoropicolinaMide
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.20250211 | 100mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS207994-10-3
- Purity/Analytical Methods: >99.0%
207994-10-3 / 5-chloro-3-fluoropyridine-2-carboxamide
Basic Information
CAS
207994-10-3
Multi CAS
No
Molecular Formula
C6H4ClFN2O
Molecular Weight
174.560000
Exact Mass
173.999619
SMILES
C1=C(C=NC(=C1F)C(=O)N)Cl
InChI
InChI=1S/C6H4ClFN2O/c7-3-1-4(8)5(6(9)11)10-2-3/h1-2H,(H2,9,11)
InChIKey
LPSRKMGUAAQVQQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
37.72
TPSA
55.98
LogP / Solubility
WLOGP
0.97
MLOGP
0.85
XLogP3
0.8
Consensus LogP
0.87
Log S (ESOL)
-1.87
Class (ESOL)
Soluble
Log S (Ali)
-1.69
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.72
Class (SILICOS-IT)
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)
-3.09
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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