CAS RN: 36023-64-0
1,4,5,6-Tetrahydro-5,6-dioxo-2,3-pyrazinedicarbonitrile
Product Availability
Choose a grade to view its available package options.
4 package records2 with current stock2 grade groups
- Product code: SSC-143128
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 5g
- Available purity: ≥98%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | ≥98% | 0 Out of Stock | Hong Kong | Inquiry |
36023-64-0 / 5,6-dioxo-1,4-dihydropyrazine-2,3-dicarbonitrile
Basic Information
CAS
36023-64-0
Multi CAS
Yes
Molecular Formula
C6H2N4O2
Molecular Weight
162.110000
Exact Mass
162.017775
InChI
InChI=1S/C6H2N4O2/c7-1-3-4(2-8)10-6(12)5(11)9-3/h(H,9,11)(H,10,12)
InChIKey
OTVDGBINMCDFTF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
H-bond acceptors
4
H-bond donors
2
Molar refractivity
37.11
TPSA
113.3
LogP / Solubility
WLOGP
-1.19
MLOGP
-1.05
XLogP3
-1.1
Consensus LogP
-1.11
Log S (ESOL)
-0.46
Class (ESOL)
Very soluble
Log S (Ali)
-0.03
Class (Ali)
Very soluble
Log S (SILICOS-IT)
0.28
Class (SILICOS-IT)
Highly 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)
-4.56
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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