CAS RN: 1379337-73-1
2,4-Dichloro-6-nitropyridine
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.20250106 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1379337-73-1
- Purity/Analytical Methods: >99.0%
1379337-73-1 / 2,4-dichloro-6-nitropyridine
Basic Information
CAS
1379337-73-1
Multi CAS
No
Molecular Formula
C5H2Cl2N2O2
Molecular Weight
192.980000
Exact Mass
191.949333
SMILES
C1=C(C=C(N=C1[N+](=O)[O-])Cl)Cl
InChI
InChI=1S/C5H2Cl2N2O2/c6-3-1-4(7)8-5(2-3)9(10)11/h1-2H
InChIKey
RHPOXXQUAPLUIU-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
40.91
TPSA
56.03
LogP / Solubility
WLOGP
2.3
MLOGP
2.02
XLogP3
2.6
Consensus LogP
2.31
Log S (ESOL)
-2.82
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.8
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.94
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)
-2.27
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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