CAS RN: 63959-47-7

6-amino-1,5-dimethylpyrimidine-2,4(1H,3H)-dione

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Batchno.20250614 100mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS63959-47-7
  • Purity/Analytical Methods: >99.0%
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63959-47-7 / 6-amino-1,5-dimethylpyrimidine-2,4-dione

Standard CAS: 63959-47-7 Multi CAS: Yes

Basic Information

CAS
63959-47-7
Multi CAS
Yes
Molecular Formula
C6H9N3O2
Molecular Weight
155.150000
Exact Mass
155.069477
InChI
InChI=1S/C6H9N3O2/c1-3-4(7)9(2)6(11)8-5(3)10/h7H2,1-2H3,(H,8,10,11)
InChIKey
OIZFMHOUKUBDHH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.33
H-bond acceptors
4
H-bond donors
2
Molar refractivity
41.45
TPSA
80.88

LogP / Solubility

WLOGP
-1.04
MLOGP
-0.92
XLogP3
-0.5
Consensus LogP
-0.82
Log S (ESOL)
-0.55
Class (ESOL)
Very soluble
Log S (Ali)
-0.08
Class (Ali)
Very soluble
Log S (SILICOS-IT)
0.19
Class (SILICOS-IT)
Highly 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)
-4.4

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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