F485-0006 Screening compound: 4-fluoro-N-{2-[2-(4-methylphenyl)-1H-1,3-benzodiazol-1-yl]ethyl}benzene-1-sulfonamide

F485-0006 Screening compound: 4-fluoro-N-{2-[2-(4-methylphenyl)-1H-1,3-benzodiazol-1-yl]ethyl}benzene-1-sulfonamide
F485-0006 Screening compound: 4-fluoro-N-{2-[2-(4-methylphenyl)-1H-1,3-benzodiazol-1-yl]ethyl}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F485-0006
4-fluoro-N-{2-[2-(4-methylphenyl)-1H-1,3-benzodiazol-1-yl]ethyl}benzene-1-sulfonamide

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

F485-0006

Molecular Formula

C22H20FN3O2S (C22 H20 FN3 O2 S)

Compound Name

4-fluoro-N-{2-[2-(4-methylphenyl)-1H-1,3-benzodiazol-1-yl]ethyl}benzene-1-sulfonamide

IUPAC name

4-fluoro-N-{2-[2-(4-methylphenyl)-1H-13-benzodiazol-1-yl]ethyl}benzene-1-sulfonamide

SMILES

Cc(cc1)ccc1-c1nc(cccc2)c2n1CCNS(c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C22H20FN3O2S/c1-16-6-8-17(9-7-16)22-25-20-4-2-3-5-21(20)26(22)15-14-24-29(27,28)19-12-10-18(23)11-13-19/h2-13,24H,14-15H2,1H3

InChI Key

BDQFWUYAXYETCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27133626

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.499

Distribution Coefficient, logD

5.485

Water Solubility, LogSw

-5.58

Polar Surface Area

51.745

Acid Dissociation Constant (pKa)

11.51

Base Dissociation Constant (pKb)

5.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

F485-0006 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
  • Cardiovascular
Targets:
  • Others

References: we are preparing a list of scientific research reports with F485-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F485-0006?
Check Price and Availability of F485-0006, 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 F485-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F485-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F485-0006
  • 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 F485-0006 available by request