D473-0554 Screening compound: N-[2-(4-fluoro-3-methylbenzenesulfonyl)-2-(pyridin-3-yl)ethyl]-4-methylbenzene-1-sulfonamide

D473-0554 Screening compound: N-[2-(4-fluoro-3-methylbenzenesulfonyl)-2-(pyridin-3-yl)ethyl]-4-methylbenzene-1-sulfonamide
D473-0554 Screening compound: N-[2-(4-fluoro-3-methylbenzenesulfonyl)-2-(pyridin-3-yl)ethyl]-4-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D473-0554
N-[2-(4-fluoro-3-methylbenzenesulfonyl)-2-(pyridin-3-yl)ethyl]-4-methylbenzene-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

D473-0554

Molecular Formula

C21H21FN2O4S2 (C21 H21 FN2 O4 S2)

Compound Name

N-[2-(4-fluoro-3-methylbenzenesulfonyl)-2-(pyridin-3-yl)ethyl]-4-methylbenzene-1-sulfonamide

IUPAC name

N-[2-(4-fluoro-3-methylbenzenesulfonyl)-2-(pyridin-3-yl)ethyl]-4-methylbenzene-1-sulfonamide

SMILES

Cc(cc1)ccc1S(NCC(c1cnccc1)S(c(cc1)cc(C)c1F)(=O)=O)(=O)=O

InChI

InChI=1S/C21H21FN2O4S2/c1-15-5-7-18(8-6-15)30(27,28)24-14-21(17-4-3-11-23-13-17)29(25,26)19-9-10-20(22)16(2)12-19/h3-13,21,24H,14H2,1-2H3/t21-/m0/s1

InChI Key

YMSLDYFBNAIZKQ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD10089277

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.54

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.612

Distribution Coefficient, logD

3.607

Water Solubility, LogSw

-3.54

Polar Surface Area

81.015

Acid Dissociation Constant (pKa)

11.31

Base Dissociation Constant (pKb)

5.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

D473-0554 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D473-0554 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D473-0554?
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What is the minimum amount of D473-0554 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D473-0554
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D473-0554
  • 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 D473-0554 available by request