0525-0008 Screening compound: 1,9-dioxa-4,6,12,14-tetraazacyclohexadecane-5,13-dithione

0525-0008 Screening compound: 1,9-dioxa-4,6,12,14-tetraazacyclohexadecane-5,13-dithione
0525-0008 Screening compound: 1,9-dioxa-4,6,12,14-tetraazacyclohexadecane-5,13-dithione alternative view

Chemical Structure Depiction of ChemDiv screening compound 0525-0008
1,9-dioxa-4,6,12,14-tetraazacyclohexadecane-5,13-dithione

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

0525-0008

Molecular Formula

C10H20N4O2S2 (C10 H20 N4 O2 S2)

Compound Name

1,9-dioxa-4,6,12,14-tetraazacyclohexadecane-5,13-dithione

IUPAC name

n/a

SMILES

S=C(NCCOCCN1)NCCOCCNC1=S

InChI

InChI=1S/C10H20N4O2S2/c17-9-11-1-5-15-6-2-13-10(18)14-4-8-16-7-3-12-9/h1-8H2,(H2,11,12,17)(H2,13,14,18)

InChI Key

DMTUQKWSBLLXTR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00628260

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

-0.825

Distribution Coefficient, logD

-0.825

Water Solubility, LogSw

-0.66

Polar Surface Area

61.918

Acid Dissociation Constant (pKa)

16.79

Base Dissociation Constant (pKb)

-0.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

80.00

0525-0008 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0525-0008 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0525-0008?
Check Price and Availability of 0525-0008, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 0525-0008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0525-0008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0525-0008
  • 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 0525-0008 available by request