F348-0493 Screening compound: ethyl 5-({N-[(2H-1,3-benzodioxol-5-yl)methyl]2,4-difluorobenzenesulfonamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

F348-0493 Screening compound: ethyl 5-({N-[(2H-1,3-benzodioxol-5-yl)methyl]2,4-difluorobenzenesulfonamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
F348-0493 Screening compound: ethyl 5-({N-[(2H-1,3-benzodioxol-5-yl)methyl]2,4-difluorobenzenesulfonamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F348-0493
ethyl 5-({N-[(2H-1,3-benzodioxol-5-yl)methyl]2,4-difluorobenzenesulfonamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

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

F348-0493

Molecular Formula

C24H24F2N2O6S (C24 H24 F2 N2 O6 S)

Compound Name

ethyl 5-({N-[(2H-1,3-benzodioxol-5-yl)methyl]2,4-difluorobenzenesulfonamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 5-({N-[(2H-13-benzodioxol-5-yl)methyl]24-difluorobenzenesulfonamido}methyl)-24-dimethyl-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(CN(Cc(cc2)cc3c2OCO3)S(c(ccc(F)c2)c2F)(=O)=O)c1C)=O

InChI

InChI=1S/C24H24F2N2O6S/c1-4-32-24(29)23-14(2)19(27-15(23)3)12-28(11-16-5-7-20-21(9-16)34-13-33-20)35(30,31)22-8-6-17(25)10-18(22)26/h5-10,27H,4,11-13H2,1-3H3

InChI Key

ACWFELAXQKRBCI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14951484

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.53

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.260

Distribution Coefficient, logD

4.260

Water Solubility, LogSw

-4.40

Polar Surface Area

80.688

Acid Dissociation Constant (pKa)

16.72

Base Dissociation Constant (pKb)

-4.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

F348-0493 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with F348-0493 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F348-0493?
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What is the minimum amount of F348-0493 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F348-0493
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F348-0493
  • 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 F348-0493 available by request