8011-8979 Screening compound: 1,1',3,3'-tetrapropyloctahydro-5H,5'H-5,5'-bi[1,3]dioxolo[4,5-c][1,2,5]thiadiazole 2,2,2',2'-tetraoxide

8011-8979 Screening compound: 1,1',3,3'-tetrapropyloctahydro-5H,5'H-5,5'-bi[1,3]dioxolo[4,5-c][1,2,5]thiadiazole 2,2,2',2'-tetraoxide
8011-8979 Screening compound: 1,1',3,3'-tetrapropyloctahydro-5H,5'H-5,5'-bi[1,3]dioxolo[4,5-c][1,2,5]thiadiazole 2,2,2',2'-tetraoxide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-8979
1,1',3,3'-tetrapropyloctahydro-5H,5'H-5,5'-bi[1,3]dioxolo[4,5-c][1,2,5]thiadiazole 2,2,2',2'-tetraoxide

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

8011-8979

Molecular Formula

C18H34N4O8S2 (C18 H34 N4 O8 S2)

Compound Name

1,1',3,3'-tetrapropyloctahydro-5H,5'H-5,5'-bi[1,3]dioxolo[4,5-c][1,2,5]thiadiazole 2,2,2',2'-tetraoxide

IUPAC name

5-{22-dioxo-13-dipropyl-tetrahydro-1H-2lambda6-[13]dioxolo[45-c][125]thiadiazol-5-yl}-13-dipropyl-tetrahydro-1H-2lambda6-[13]dioxolo[45-c][125]thiadiazole-22-dione

SMILES

CCCN(C1OC(C(OC2N3CCC)OC2N(CCC)S3(=O)=O)OC1N1CCC)S1(=O)=O

InChI

InChI=1S/C18H34N4O8S2/c1-5-9-19-13-14(20(10-6-2)31(19,23)24)28-17(27-13)18-29-15-16(30-18)22(12-8-4)32(25,26)21(15)11-7-3/h13-18H,5-12H2,1-4H3

InChI Key

WTXJUPLAFYQRIQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02319992

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.62

Hydrogen Bond Acceptors Count

16.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

1.788

Distribution Coefficient, logD

1.788

Water Solubility, LogSw

-1.57

Polar Surface Area

104.759

Acid Dissociation Constant (pKa)

27.74

Base Dissociation Constant (pKb)

-4.81

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

100.00

References: we are preparing a list of scientific research reports with 8011-8979 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-8979?
Check Price and Availability of 8011-8979, 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 8011-8979 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-8979
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-8979
  • 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 8011-8979 available by request