0242-0165 Screening compound: 12,13-dibromo-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecine

0242-0165 Screening compound: 12,13-dibromo-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecine
0242-0165 Screening compound: 12,13-dibromo-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0242-0165
12,13-dibromo-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecine

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

0242-0165

Molecular Formula

C12H14Br2O4 (C12 H14 Br2 O4)

Compound Name

12,13-dibromo-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecine

IUPAC name

n/a

SMILES

Brc(cc1OCCOCCOCCOc1c1)c1Br

InChI

InChI=1S/C12H14Br2O4/c13-9-7-11-12(8-10(9)14)18-6-4-16-2-1-15-3-5-17-11/h7-8H,1-6H2

InChI Key

LROGNZUKBSTBCG-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.05

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.998

Distribution Coefficient, logD

1.998

Water Solubility, LogSw

-1.87

Polar Surface Area

32.210

Acid Dissociation Constant (pKa)

28.63

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 0242-0165 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0242-0165?
Check Price and Availability of 0242-0165, 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 0242-0165 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0242-0165
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0242-0165
  • 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 0242-0165 available by request