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CAS 396092-84-5 4-N,N-Dimethylamino-2-(tributylstannyl)-pyridine molecular structure lightbox
CAS RN: 396092-84-5

4-N,N-Dimethylamino-2-(tributylstannyl)-pyridine

  • Product code: SSC-147306
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 396092-84-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 0 Out of Stock Hong Kong Inquiry
0.25g >95% 0 Out of Stock Hong Kong Inquiry
1g >95% 0 Out of Stock Beijing Inquiry
5g >95% 0 Out of Stock Hong Kong Inquiry

396092-84-5 / N,N-dimethyl-2-tributylstannylpyridin-4-amine

Standard CAS: 396092-84-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
396092-84-5
Multi CAS
No
Molecular Formula
C19H36N3S
Molecular Weight
411.200000
Exact Mass
412.190052
InChI
InChI=1S/C7H9N2.3C4H9.Sn/c1-9(2)7-3-5-8-6-4-7;3*1-3-4-2;/h3-5H,1-2H3;3*1,3-4H2,2H3;
InChIKey
WQSBQMYSWJWDDG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.74
Rotatable bonds
11
H-bond acceptors
2
Molar refractivity
103.1
TPSA
16.13

LogP / Solubility

WLOGP
5.2
MLOGP
4.6
XLogP3
5.2
Consensus LogP
5
Log S (ESOL)
-5.14
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.69
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.97
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.53

Drug-likeness / Medicinal Chemistry

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

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