![CAS 337463-64-6 6-NITRO-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/337463-64-6.gif)
CAS RN: 337463-64-6
6-NITRO-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
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.20250705 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS337463-64-6
- Purity/Analytical Methods: >99.0%
337463-64-6 / 6-nitro-4H-pyrido[3,2-b][1,4]oxazin-3-one
Basic Information
CAS
337463-64-6
Multi CAS
Yes
Molecular Formula
C7H5N3O4
Molecular Weight
195.130000
Exact Mass
195.028006
InChI
InChI=1S/C7H5N3O4/c11-6-3-14-4-1-2-5(10(12)13)8-7(4)9-6/h1-2H,3H2,(H,8,9,11)
InChIKey
JANHQSAAMLBUOH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
1
Molar refractivity
45.02
TPSA
94.36
LogP / Solubility
WLOGP
0.32
MLOGP
0.28
XLogP3
0.3
Consensus LogP
0.3
Log S (ESOL)
-1.5
Class (ESOL)
Soluble
Log S (Ali)
-1.39
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.31
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)
-3.68
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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