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CAS 875339-66-5 7-chloro-2-tributylstannanyl-thieno[3,2-b]pyridine molecular structure lightbox
CAS RN: 875339-66-5

7-chloro-2-tributylstannanyl-thieno[3,2-b]pyridine

  • Product code: SSC-197639
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 875339-66-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 1 In Stock Shanghai Inquiry
0.25g ≥95% 1 In Stock Beijing Inquiry
1g ≥95% 1 In Stock Shenzhen Inquiry
5g ≥95% 1 In Stock Hong Kong Inquiry

875339-66-5 / tributyl-(7-chlorothieno[3,2-b]pyridin-2-yl)stannane

Standard CAS: 875339-66-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
875339-66-5
Multi CAS
Yes
Molecular Formula
C19H30CLNSSN
Molecular Weight
458.700000
Exact Mass
459.080951
InChI
InChI=1S/C7H3ClNS.3C4H9.Sn/c8-5-1-3-9-6-2-4-10-7(5)6;3*1-3-4-2;/h1-3H;3*1,3-4H2,2H3;
InChIKey
OQLOAKBBORZGFN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
9
Fraction Csp3
0.63
Rotatable bonds
10
H-bond acceptors
2
Molar refractivity
109.16
TPSA
12.89

LogP / Solubility

WLOGP
7.01
MLOGP
6.2
XLogP3
7.01
Consensus LogP
6.74
Log S (ESOL)
-6.73
Class (ESOL)
Insoluble
Log S (Ali)
-8.38
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.66
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.54

Drug-likeness / Medicinal Chemistry

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

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