![CAS 5770-44-5 6-[N-(2-Hydroxyethyl)amino]-1,3-dimethyl-2,4(1H,3H)-dione molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/5770-44-5.gif)
CAS RN: 5770-44-5
6-[N-(2-Hydroxyethyl)amino]-1,3-dimethyl-2,4(1H,3H)-dione
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.20250516 | 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS5770-44-5
- Purity/Analytical Methods: >99.0%
5770-44-5 / 6-(2-hydroxyethylamino)-1,3-dimethylpyrimidine-2,4-dione
Basic Information
CAS
5770-44-5
Multi CAS
Yes
Molecular Formula
C8H13N3O3
Molecular Weight
199.210000
Exact Mass
199.095691
InChI
InChI=1S/C8H13N3O3/c1-10-6(9-3-4-12)5-7(13)11(2)8(10)14/h5,9,12H,3-4H2,1-2H3
InChIKey
XANWQZBIYRXADC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
6
H-bond donors
2
Molar refractivity
52.5
TPSA
76.26
LogP / Solubility
WLOGP
-1.51
MLOGP
-1.33
XLogP3
-1.1
Consensus LogP
-1.31
Log S (ESOL)
-0.24
Class (ESOL)
Very soluble
Log S (Ali)
-0.1
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.06
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
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)
-5.01
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
![CAS 5771-32-4 spiro[2.4]heptan-7-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/5771-32-4.gif)
![CAS 5771-58-4 Bicyclo[4.1.0]heptan-2-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/5771-58-4.gif)
