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CAS 32736-91-7 Pyrazine, 2,5-diethyl-3-methyl- (8CI,9CI) molecular structure lightbox
CAS RN: 32736-91-7

Pyrazine, 2,5-diethyl-3-methyl- (8CI,9CI)

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250125 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS32736-91-7
  • Purity/Analytical Methods: >99.0%
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32736-91-7 / 2,5-diethyl-3-methylpyrazine

Standard CAS: 32736-91-7 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
32736-91-7
Multi CAS
No
Molecular Formula
C9H14N2
Molecular Weight
150.220000
Exact Mass
150.115698
InChI
InChI=1S/C9H14N2/c1-4-8-6-10-9(5-2)7(3)11-8/h6H,4-5H2,1-3H3
InChIKey
RJIREWQSLPRZFG-UHFFFAOYSA-N

Physical Properties

Boiling Point
95.00 °C. @ 14.00 mm Hg
Density
0.944-0.954
Physical Description
colourless to light yellow liquid with a toasted hazelnut, meaty odour
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
45.53
TPSA
25.78

LogP / Solubility

WLOGP
1.91
MLOGP
1.67
XLogP3
1.9
Consensus LogP
1.83
Log S (ESOL)
-2.25
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.17
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.46
Class (SILICOS-IT)
Moderately 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)
-2.28

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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