CAS RN: 89533-23-3

N-(6-amino-pyrimidin-4-yl)-acetamide

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Batchno.20260512 250mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS89533-23-3
  • Purity/Analytical Methods: >99.0%
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89533-23-3 / N-(6-aminopyrimidin-4-yl)acetamide

Standard CAS: 89533-23-3 Multi CAS: No

Basic Information

CAS
89533-23-3
Multi CAS
No
Molecular Formula
C6H8N4O
Molecular Weight
152.150000
Exact Mass
152.069811
InChI
InChI=1S/C6H8N4O/c1-4(11)10-6-2-5(7)8-3-9-6/h2-3H,1H3,(H3,7,8,9,10,11)
InChIKey
GIFKGKBGMJCGJH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
40.75
TPSA
80.9

LogP / Solubility

WLOGP
0.02
MLOGP
0.01
XLogP3
-0.6
Consensus LogP
-0.19
Log S (ESOL)
-1.13
Class (ESOL)
Soluble
Log S (Ali)
-0.82
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.78
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
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)
-3.64

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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