CAS RN: 110223-15-9
2-AMINOL-3-BENZYLOXYPYRAZINE
Product Availability
Choose a grade to view its available package options.
5 package records3 with current stock2 grade groups
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251231 | 50mg / 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS110223-15-9
- Purity/Analytical Methods: >99.0%
110223-15-9 / 3-phenylmethoxypyrazin-2-amine
3-(benzyloxy)pyrazin-2-amine | DTXSID50552084 | RefChem:275148
Basic Information
CAS
110223-15-9
Multi CAS
No
Molecular Formula
C11H11N3O
Molecular Weight
201.220000
Exact Mass
201.090212
SMILES
C1=CC=C(C=C1)COC2=NC=CN=C2N
InChI
InChI=1S/C11H11N3O/c12-10-11(14-7-6-13-10)15-8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,12,13)
InChIKey
QKEQFJXWHGVJJU-UHFFFAOYSA-N
Synonyms
3-(benzyloxy)pyrazin-2-amine
DTXSID50552084
RefChem:275148
DTXCID50502867
2-AMINO-3-BENZYLOXYPYRAZINE
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
12
Fraction Csp3
0.09
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
1
Molar refractivity
57.22
TPSA
61.03
LogP / Solubility
WLOGP
1.64
MLOGP
1.44
XLogP3
1.2
Consensus LogP
1.43
Log S (ESOL)
-2.51
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.39
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.69
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.78
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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