8017-9463 Screening compound: 1-[(2-{[amino(imino)methyl]sulfanyl}ethyl)sulfanyl]decane

8017-9463 Screening compound: 1-[(2-{[amino(imino)methyl]sulfanyl}ethyl)sulfanyl]decane
8017-9463 Screening compound: 1-[(2-{[amino(imino)methyl]sulfanyl}ethyl)sulfanyl]decane alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-9463
1-[(2-{[amino(imino)methyl]sulfanyl}ethyl)sulfanyl]decane

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8017-9463

Molecular Formula

C13H28N2S2 (C13 H28 N2 S2)

Compound Name

1-[(2-{[amino(imino)methyl]sulfanyl}ethyl)sulfanyl]decane

IUPAC name

{[2-(decylsulfanyl)ethyl]sulfanyl}methanimidamide

SMILES

CCCCCCCCCCSCCSC(N)=N

InChI

InChI=1S/C13H28N2S2/c1-2-3-4-5-6-7-8-9-10-16-11-12-17-13(14)15/h2-12H2,1H3,(H3,14,15)

InChI Key

LPAYNEJETZUCJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06619393

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

276.51

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.875

Distribution Coefficient, logD

3.365

Water Solubility, LogSw

-4.81

Polar Surface Area

40.281

Acid Dissociation Constant (pKa)

15.77

Base Dissociation Constant (pKb)

8.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

92.31

8017-9463 in Drug Discovery

Included in Screening Libraries

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8017-9463 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-9463?
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What is the minimum amount of 8017-9463 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-9463
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-9463
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8017-9463 available by request