CAS RN: 1805275-83-5
6-Fluoro-2-nitro-pyridin-3-ylamine
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.20250220 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1805275-83-5
- Purity/Analytical Methods: >99.0%
1805275-83-5 / 6-fluoro-2-nitropyridin-3-amine
Basic Information
CAS
1805275-83-5
Multi CAS
No
Molecular Formula
C5H4FN3O2
Molecular Weight
157.100000
Exact Mass
157.028755
SMILES
C1=CC(=NC(=C1N)[N+](=O)[O-])F
InChI
InChI=1S/C5H4FN3O2/c6-4-2-1-3(7)5(8-4)9(10)11/h1-2H,7H2
InChIKey
LLRHWBNNAKIDAT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
35.26
TPSA
82.05
LogP / Solubility
WLOGP
0.71
MLOGP
0.62
XLogP3
1.3
Consensus LogP
0.88
Log S (ESOL)
-1.6
Class (ESOL)
Soluble
Log S (Ali)
-1.36
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.39
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.17
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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