8009-7124 Screening compound: 3,7-dibromo-9a,9b-diethyl-2,8-bis(ethylsulfanyl)-4,4,5,5,6,6-hexafluoro-5,6,9a,9b-tetrahydro-4H-thieno[2',3':6,7]indeno[5,4-b]thiophene

8009-7124 Screening compound: 3,7-dibromo-9a,9b-diethyl-2,8-bis(ethylsulfanyl)-4,4,5,5,6,6-hexafluoro-5,6,9a,9b-tetrahydro-4H-thieno[2',3':6,7]indeno[5,4-b]thiophene
8009-7124 Screening compound: 3,7-dibromo-9a,9b-diethyl-2,8-bis(ethylsulfanyl)-4,4,5,5,6,6-hexafluoro-5,6,9a,9b-tetrahydro-4H-thieno[2',3':6,7]indeno[5,4-b]thiophene alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-7124
3,7-dibromo-9a,9b-diethyl-2,8-bis(ethylsulfanyl)-4,4,5,5,6,6-hexafluoro-5,6,9a,9b-tetrahydro-4H-thieno[2',3':6,7]indeno[5,4-b]thiophene

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

8009-7124

Molecular Formula

C21H20Br2F6S4 (C21 H20 Br2 F6 S4)

Compound Name

3,7-dibromo-9a,9b-diethyl-2,8-bis(ethylsulfanyl)-4,4,5,5,6,6-hexafluoro-5,6,9a,9b-tetrahydro-4H-thieno[2',3':6,7]indeno[5,4-b]thiophene

IUPAC name

513-dibromo-12-diethyl-414-bis(ethylsulfanyl)-88991010-hexafluoro-315-dithiatetracyclo[10.3.0.0^{26}.0^{711}]pentadeca-461113-tetraene

SMILES

CCC1(C2=C(C(C(C3(F)F)(F)F)(F)F)C3=C3C(Br)=C(SCC)SC13CC)SC(SCC)=C2Br

InChI

InChI=1S/C21H20Br2F6S4/c1-5-17-11(13(22)15(32-17)30-7-3)9-10(20(26,27)21(28,29)19(9,24)25)12-14(23)16(31-8-4)33-18(12,17)6-2/h5-8H2,1-4H3

InChI Key

GTTKSNOGUMVQOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01819830

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

674.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

n/a

Partition Coefficient, logP

10.142

Distribution Coefficient, logD

10.142

Water Solubility, LogSw

-6.02

Polar Surface Area

0.000

Acid Dissociation Constant (pKa)

27.86

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

61.90

References: we are preparing a list of scientific research reports with 8009-7124 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 8009-7124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-7124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-7124
  • 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 8009-7124 available by request