![CAS 34945-66-9 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine-7-carbonitrile molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/34945-66-9.gif)
CAS RN: 34945-66-9
3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine-7-carbonitrile
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.20251107 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS34945-66-9
- Purity/Analytical Methods: >99.0%
34945-66-9 / 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine-7-carbonitrile
Basic Information
CAS
34945-66-9
Multi CAS
No
Molecular Formula
C8H7N3O
Molecular Weight
161.160000
Exact Mass
161.058912
InChI
InChI=1S/C8H7N3O/c9-4-6-3-7-8(11-5-6)10-1-2-12-7/h3,5H,1-2H2,(H,10,11)
InChIKey
YURHKHQTVHXOKY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.25
H-bond acceptors
4
H-bond donors
1
Molar refractivity
42.94
TPSA
57.94
LogP / Solubility
WLOGP
0.76
MLOGP
0.66
XLogP3
0.6
Consensus LogP
0.67
Log S (ESOL)
-1.69
Class (ESOL)
Soluble
Log S (Ali)
-1.43
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.34
Class (SILICOS-IT)
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)
-3.17
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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![CAS 34950-82-8 7-Bromo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/34950-82-8.gif)
