1611-0374 Screening compound: 1,4-bis(3,4-dimethylphenoxy)-2,3,5,6-tetrafluorobenzene

1611-0374 Screening compound: 1,4-bis(3,4-dimethylphenoxy)-2,3,5,6-tetrafluorobenzene
1611-0374 Screening compound: 1,4-bis(3,4-dimethylphenoxy)-2,3,5,6-tetrafluorobenzene alternative view

Chemical Structure Depiction of ChemDiv screening compound 1611-0374
1,4-bis(3,4-dimethylphenoxy)-2,3,5,6-tetrafluorobenzene

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

1611-0374

Molecular Formula

C22H18F4O2 (C22 H18 F4 O2)

Compound Name

1,4-bis(3,4-dimethylphenoxy)-2,3,5,6-tetrafluorobenzene

IUPAC name

14-bis(34-dimethylphenoxy)-2356-tetrafluorobenzene

SMILES

Cc(cc1)c(C)cc1Oc(c(F)c(c(Oc1cc(C)c(C)cc1)c1F)F)c1F

InChI

InChI=1S/C22H18F4O2/c1-11-5-7-15(9-13(11)3)27-21-17(23)19(25)22(20(26)18(21)24)28-16-8-6-12(2)14(4)10-16/h5-10H,1-4H3

InChI Key

KKEGNKCNXUANMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00349924

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.38

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

7.866

Distribution Coefficient, logD

7.866

Water Solubility, LogSw

-5.92

Polar Surface Area

14.080

Acid Dissociation Constant (pKa)

28.43

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

1611-0374 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1611-0374 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1611-0374?
Check Price and Availability of 1611-0374, 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 1611-0374 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1611-0374
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1611-0374
  • 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 1611-0374 available by request