CAS RN: 2379-57-9
DNQX
Product Availability
Choose a grade to view its available package options.
10 package records9 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250727 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260123 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20251012 | 1mg | In stock | Shanghai | Inquiry | |
| Batchno.20260618 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20260518 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20260102 | 50mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS2379-57-9
- Purity/Analytical Methods: >99.0%
2379-57-9 / 6,7-dinitro-1,4-dihydroquinoxaline-2,3-dione
Basic Information
CAS
2379-57-9
Multi CAS
No
Molecular Formula
C8H4N4O6
Molecular Weight
252.140000
Exact Mass
252.013084
SMILES
C1=C2C(=CC(=C1[N+](=O)[O-])[N+](=O)[O-])NC(=O)C(=O)N2
InChI
InChI=1S/C8H4N4O6/c13-7-8(14)10-4-2-6(12(17)18)5(11(15)16)1-3(4)9-7/h1-2H,(H,9,13)(H,10,14)
InChIKey
RWVIMCIPOAXUDG-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
10
Rotatable bonds
2
H-bond acceptors
6
H-bond donors
2
Molar refractivity
58.5
TPSA
152
LogP / Solubility
WLOGP
0.03
MLOGP
0.04
XLogP3
0.1
Consensus LogP
0.06
Log S (ESOL)
-1.7
Class (ESOL)
Soluble
Log S (Ali)
-1.65
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.57
Class (SILICOS-IT)
Soluble
ADME
GI absorption
Low
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)
-4.23
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
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