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CAS 446286-90-4 2-BROMO-5-(PIPERAZIN-1-YL)PYRAZINE molecular structure lightbox
CAS RN: 446286-90-4

2-BROMO-5-(PIPERAZIN-1-YL)PYRAZINE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260604 25mg / 100mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS446286-90-4
  • Purity/Analytical Methods: >99.0%
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446286-90-4 / 2-bromo-5-piperazin-1-ylpyrazine

Standard CAS: 446286-90-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
446286-90-4
Multi CAS
No
Molecular Formula
BC8H11Rn4
Molecular Weight
243.100000
Exact Mass
242.016710
InChI
InChI=1S/C8H11BrN4/c9-7-5-12-8(6-11-7)13-3-1-10-2-4-13/h5-6,10H,1-4H2
InChIKey
PQTLIQZJZHJUPD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
54.81
TPSA
41.05

LogP / Solubility

WLOGP
0.65
MLOGP
0.58
XLogP3
0.6
Consensus LogP
0.61
Log S (ESOL)
-2.03
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.02
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.9
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)
-3.74

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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