CAS RN: 822-63-9
5-AMINO-2,3-DIHYDRO-1,2-OXAZOL-3-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.20250223 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS822-63-9
- Purity/Analytical Methods: >99.0%
822-63-9 / 5-amino-1,2-oxazol-3-one
Basic Information
CAS
822-63-9
Multi CAS
Yes
Molecular Formula
C3H4N2O2
Molecular Weight
100.080000
Exact Mass
100.027277
InChI
InChI=1S/C3H4N2O2/c4-2-1-3(6)5-7-2/h1H,4H2,(H,5,6)
InChIKey
SBAQXOKGHJGIGF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Aromatic heavy atom count
5
H-bond acceptors
3
H-bond donors
2
Molar refractivity
23.74
TPSA
72.02
LogP / Solubility
WLOGP
-0.45
MLOGP
-0.41
XLogP3
-0.8
Consensus LogP
-0.55
Log S (ESOL)
-0.71
Class (ESOL)
Very soluble
Log S (Ali)
-0.06
Class (Ali)
Very soluble
Log S (SILICOS-IT)
0.06
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
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)
-3.65
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
-
-
-
-
5-methylbicyclo[2.2.1]hept-2-ene
- CAS RN: 822-96-8
- Product Code: starshine_CAS822-96-8
- Purity/Analytical method: >99.0%
![CAS 822-96-8 5-methylbicyclo[2.2.1]hept-2-ene molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/822-96-8.gif)