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CAS 84468-52-0 2,3-Dimethyl-piperazine molecular structure lightbox
CAS RN: 84468-52-0

2,3-Dimethyl-piperazine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250208 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS84468-52-0
  • Purity/Analytical Methods: >99.0%
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84468-52-0 / 2,3-dimethylpiperazine

Standard CAS: 84468-52-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
84468-52-0
Multi CAS
Yes
Molecular Formula
C6H14N2
Molecular Weight
114.190000
Exact Mass
114.115698
InChI
InChI=1S/C6H14N2/c1-5-6(2)8-4-3-7-5/h5-8H,3-4H2,1-2H3
InChIKey
COWPTMLRSANSMQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
34.93
TPSA
24.06

LogP / Solubility

WLOGP
-0.04
MLOGP
-0.05
Consensus LogP
-0.03
Log S (ESOL)
-0.52
Class (ESOL)
Very soluble
Log S (Ali)
-0.46
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.37
Class (SILICOS-IT)
Very 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)
-3.45

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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