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CAS 773844-46-5 2-(1H-iMidazol-4-yl)pyrazine molecular structure lightbox
CAS RN: 773844-46-5

2-(1H-iMidazol-4-yl)pyrazine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251107 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS773844-46-5
  • Purity/Analytical Methods: >99.0%
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773844-46-5 / 2-(1H-imidazol-5-yl)pyrazine

Standard CAS: 773844-46-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
773844-46-5
Multi CAS
No
Molecular Formula
C7H6N4
Molecular Weight
146.150000
Exact Mass
146.059246
InChI
InChI=1S/C7H6N4/c1-2-10-6(3-8-1)7-4-9-5-11-7/h1-5H,(H,9,11)
InChIKey
RDWKKNZHUNFGRQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
11
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
39.61
TPSA
54.46

LogP / Solubility

WLOGP
0.87
MLOGP
0.76
XLogP3
-0.4
Consensus LogP
0.41
Log S (ESOL)
-1.97
Class (ESOL)
Soluble
Log S (Ali)
-1.38
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.45
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

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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