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CAS 173314-97-1 6-((trimethylsilyl)ethynyl)pyridin-2-amine molecular structure lightbox
CAS RN: 173314-97-1

6-((trimethylsilyl)ethynyl)pyridin-2-amine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250909 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS173314-97-1
  • Purity/Analytical Methods: >99.0%
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173314-97-1 / 6-(2-trimethylsilylethynyl)pyridin-2-amine

Standard CAS: 173314-97-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
173314-97-1
Multi CAS
No
Molecular Formula
C10H14N2Si
Molecular Weight
190.320000
Exact Mass
190.092625
SMILES
C[Si](C)(C)C#CC1=NC(=CC=C1)N
InChI
InChI=1S/C10H14N2Si/c1-13(2,3)8-7-9-5-4-6-10(11)12-9/h4-6H,1-3H3,(H2,11,12)
InChIKey
BOROCMHVWMOVLY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
58.87
TPSA
38.91

LogP / Solubility

WLOGP
1.89
MLOGP
1.66
XLogP3
1.89
Consensus LogP
1.81
Log S (ESOL)
-2.55
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.49
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.47
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)
-2.54

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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