CAS RN: 20348-23-6
3,4-Dihydro-2H-pyrido[3,2-b][1,4]oxazine
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Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 0.25g, 1g, 5g, 10g
- Available purity: >97%
- Inventory rows with stock: 4
- Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 20348-23-6
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 0.25g |
>97% |
5
In Stock
|
Hong Kong |
Inquiry |
| 1g |
>97% |
5
In Stock
|
Shanghai |
Inquiry |
| 5g |
>97% |
5
In Stock
|
Shenzhen |
Inquiry |
| 10g |
>97% |
5
In Stock
|
Hong Kong |
Inquiry |
20348-23-6 / 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
Standard CAS: 20348-23-6
Multi CAS: No
Basic Information
CAS
20348-23-6
Multi CAS
No
Molecular Formula
C7H8N2O
Molecular Weight
136.150000
Exact Mass
136.063663
SMILES
C1COC2=C(N1)N=CC=C2
InChI
InChI=1S/C7H8N2O/c1-2-6-7(8-3-1)9-4-5-10-6/h1-3H,4-5H2,(H,8,9)
InChIKey
QQVXDMFULJVZLA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.29
H-bond acceptors
3
H-bond donors
1
Molar refractivity
38.22
TPSA
34.15
LogP / Solubility
WLOGP
0.89
MLOGP
0.77
XLogP3
0.9
Consensus LogP
0.85
Log S (ESOL)
-1.69
Class (ESOL)
Soluble
Log S (Ali)
-1.32
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.28
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)
-2.92
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264+P265, P280, P305+P351+P338, and P337+P317