CAS RN: 56817-23-3

7-Chloro-Imidazo[1,2-C]Pyrimidin-5-Ol

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Batchno.20250413 100mg / 250mg / 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS56817-23-3
  • Purity/Analytical Methods: >99.0%
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56817-23-3 / 7-chloroimidazo[1,2-c]pyrimidin-5-olate

Standard CAS: 56817-23-3 Multi CAS: Yes

Basic Information

CAS
56817-23-3
Multi CAS
Yes
Molecular Formula
C6H3CLN3O
Molecular Weight
168.560000
Exact Mass
167.996464
InChI
InChI=1S/C6H4ClN3O/c7-4-3-5-8-1-2-10(5)6(11)9-4/h1-3H,(H,9,11)
InChIKey
MORDDYJPVSRHAG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
4
Molar refractivity
37.44
TPSA
53.25

LogP / Solubility

WLOGP
0.46
MLOGP
0.4
XLogP3
2.7
Consensus LogP
1.19
Log S (ESOL)
-1.78
Class (ESOL)
Soluble
Log S (Ali)
-1.27
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.13
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)
-3.42

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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