F065-5019 Screening compound: methyl 1-methyl-4-[(2-{[(3-methylphenyl)methyl]carbamoyl}ethyl)sulfamoyl]-1H-pyrrole-2-carboxylate

F065-5019 Screening compound: methyl 1-methyl-4-[(2-{[(3-methylphenyl)methyl]carbamoyl}ethyl)sulfamoyl]-1H-pyrrole-2-carboxylate
F065-5019 Screening compound: methyl 1-methyl-4-[(2-{[(3-methylphenyl)methyl]carbamoyl}ethyl)sulfamoyl]-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F065-5019
methyl 1-methyl-4-[(2-{[(3-methylphenyl)methyl]carbamoyl}ethyl)sulfamoyl]-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

F065-5019

Molecular Formula

C18H23N3O5S (C18 H23 N3 O5 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1cccc(CNC(CCNS(c2cn(C)c(C(OC)=O)c2)(=O)=O)=O)c1

InChI

InChI=1S/C18H23N3O5S/c1-13-5-4-6-14(9-13)11-19-17(22)7-8-20-27(24,25)15-10-16(18(23)26-3)21(2)12-15/h4-6,9-10,12,20H,7-8,11H2,1-3H3,(H,19,22)

InChI Key

SJFLPBXCRUDEKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14939055

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.46

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.558

Distribution Coefficient, logD

1.558

Water Solubility, LogSw

-2.39

Polar Surface Area

89.793

Acid Dissociation Constant (pKa)

11.22

Base Dissociation Constant (pKb)

-2.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with F065-5019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F065-5019?
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What is the minimum amount of F065-5019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F065-5019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F065-5019
  • 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 F065-5019 available by request