F065-3587 Screening compound: methyl 4-({[(3-chloro-2-methylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate

F065-3587 Screening compound: methyl 4-({[(3-chloro-2-methylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate
F065-3587 Screening compound: methyl 4-({[(3-chloro-2-methylphenyl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F065-3587
methyl 4-({[(3-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

F065-3587

Molecular Formula

C17H20ClN3O5S (C17 H20 ClN3 O5 S)

Compound Name

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

IUPAC name

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

SMILES

Cc(c(NC(CN(C)S(c1cn(C)c(C(OC)=O)c1)(=O)=O)=O)ccc1)c1Cl

InChI

InChI=1S/C17H20ClN3O5S/c1-11-13(18)6-5-7-14(11)19-16(22)10-21(3)27(24,25)12-8-15(17(23)26-4)20(2)9-12/h5-9H,10H2,1-4H3,(H,19,22)

InChI Key

LKCNLONWWOXBRP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14938874

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.88

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.078

Distribution Coefficient, logD

2.076

Water Solubility, LogSw

-3.02

Polar Surface Area

78.738

Acid Dissociation Constant (pKa)

9.71

Base Dissociation Constant (pKb)

-1.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

References: we are preparing a list of scientific research reports with F065-3587 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F065-3587?
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What is the minimum amount of F065-3587 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F065-3587
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F065-3587
  • 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 F065-3587 available by request