F065-4426 Screening compound: ethyl 4-({[(3-ethylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate

F065-4426 Screening compound: ethyl 4-({[(3-ethylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate
F065-4426 Screening compound: ethyl 4-({[(3-ethylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F065-4426
ethyl 4-({[(3-ethylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-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

F065-4426

Molecular Formula

C19H25N3O5S (C19 H25 N3 O5 S)

Compound Name

ethyl 4-({[(3-ethylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-({[(3-ethylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate

SMILES

CCc1cccc(NC(CN(C)S(c2cn(C)c(C(OCC)=O)c2)(=O)=O)=O)c1

InChI

InChI=1S/C19H25N3O5S/c1-5-14-8-7-9-15(10-14)20-18(23)13-22(4)28(25,26)16-11-17(21(3)12-16)19(24)27-6-2/h7-12H,5-6,13H2,1-4H3,(H,20,23)

InChI Key

VTQMFGQTULXVBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14938978

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.517

Distribution Coefficient, logD

2.517

Water Solubility, LogSw

-2.83

Polar Surface Area

79.016

Acid Dissociation Constant (pKa)

12.03

Base Dissociation Constant (pKb)

-0.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

References: we are preparing a list of scientific research reports with F065-4426 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F065-4426?
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What is the minimum amount of F065-4426 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F065-4426
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F065-4426
  • 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 F065-4426 available by request