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CAS 57892-73-6 Imidazo(1,2-a)pyrimidine-2-aceticacid molecular structure lightbox
CAS RN: 57892-73-6

Imidazo(1,2-a)pyrimidine-2-aceticacid

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260218 100mg / 250mg / 500mg Out of stock 1 business days Inquiry
  • Product code: starshine_CAS57892-73-6
  • Purity/Analytical Methods: >99.0%
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57892-73-6 / 2-imidazo[1,2-a]pyrimidin-2-ylacetic acid

Standard CAS: 57892-73-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
57892-73-6
Multi CAS
Yes
Molecular Formula
C8H7N3O2
Molecular Weight
177.160000
Exact Mass
177.053826
InChI
InChI=1S/C8H7N3O2/c12-7(13)4-6-5-11-3-1-2-9-8(11)10-6/h1-3,5H,4H2,(H,12,13)
InChIKey
RLORFBCHRYBAEG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
9
Fraction Csp3
0.12
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
44.33
TPSA
67.49

LogP / Solubility

WLOGP
0.36
MLOGP
0.31
XLogP3
0.6
Consensus LogP
0.42
Log S (ESOL)
-1.54
Class (ESOL)
Soluble
Log S (Ali)
-1.27
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.35
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
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)
-3.55

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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