F065-4319 Screening compound: ethyl 4-({[(5-chloro-2-methylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate

F065-4319 Screening compound: ethyl 4-({[(5-chloro-2-methylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate
F065-4319 Screening compound: ethyl 4-({[(5-chloro-2-methylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F065-4319
ethyl 4-({[(5-chloro-2-methylphenyl)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

F065-4319

Molecular Formula

C18H22ClN3O5S (C18 H22 ClN3 O5 S)

Compound Name

ethyl 4-({[(5-chloro-2-methylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-({[(5-chloro-2-methylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate

SMILES

CCOC(c1cc(S(N(C)CC(Nc2c(C)ccc(Cl)c2)=O)(=O)=O)cn1C)=O

InChI

InChI=1S/C18H22ClN3O5S/c1-5-27-18(24)16-9-14(10-21(16)3)28(25,26)22(4)11-17(23)20-15-8-13(19)7-6-12(15)2/h6-10H,5,11H2,1-4H3,(H,20,23)

InChI Key

IUDSGUSLZSBCQR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14938929

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.91

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

2.183

Distribution Coefficient, logD

2.181

Water Solubility, LogSw

-3.23

Polar Surface Area

78.318

Acid Dissociation Constant (pKa)

9.71

Base Dissociation Constant (pKb)

-1.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

F065-4319 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with F065-4319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F065-4319?
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What is the minimum amount of F065-4319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F065-4319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F065-4319
  • 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 F065-4319 available by request