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CAS 936112-80-0 2-(2-methoxyethoxy)-4-pyridinamine molecular structure lightbox
CAS RN: 936112-80-0

2-(2-methoxyethoxy)-4-pyridinamine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260203 100mg / 250mg / 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS936112-80-0
  • Purity/Analytical Methods: >99.0%
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936112-80-0 / 2-(2-methoxyethoxy)pyridin-4-amine

Standard CAS: 936112-80-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
936112-80-0
Multi CAS
No
Molecular Formula
C8H12N2O2
Molecular Weight
168.190000
Exact Mass
168.089878
InChI
InChI=1S/C8H12N2O2/c1-11-4-5-12-8-6-7(9)2-3-10-8/h2-3,6H,4-5H2,1H3,(H2,9,10)
InChIKey
LXAHVQMTGOPYDQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.38
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
1
Molar refractivity
46.02
TPSA
57.37

LogP / Solubility

WLOGP
0.69
MLOGP
0.6
XLogP3
0.3
Consensus LogP
0.53
Log S (ESOL)
-1.42
Class (ESOL)
Soluble
Log S (Ali)
-1.44
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.81
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)
-3.26

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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