F065-4300 Screening compound: ethyl 4-({[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate

F065-4300 Screening compound: ethyl 4-({[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate
F065-4300 Screening compound: ethyl 4-({[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F065-4300
ethyl 4-({[(6-methoxy-1,3-benzothiazol-2-yl)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

F065-4300

Molecular Formula

C19H22N4O6S2 (C19 H22 N4 O6 S2)

Compound Name

ethyl 4-({[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-({[(6-methoxy-13-benzothiazol-2-yl)carbamoyl]methyl}(methyl)sulfamoyl)-1-methyl-1H-pyrrole-2-carboxylate

SMILES

CCOC(c1cc(S(N(C)CC(Nc2nc(ccc(OC)c3)c3s2)=O)(=O)=O)cn1C)=O

InChI

InChI=1S/C19H22N4O6S2/c1-5-29-18(25)15-9-13(10-22(15)2)31(26,27)23(3)11-17(24)21-19-20-14-7-6-12(28-4)8-16(14)30-19/h6-10H,5,11H2,1-4H3,(H,20,21,24)

InChI Key

LLDPZUWOLZOXMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14938917

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.54

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.552

Distribution Coefficient, logD

2.552

Water Solubility, LogSw

-3.00

Polar Surface Area

96.321

Acid Dissociation Constant (pKa)

10.74

Base Dissociation Constant (pKb)

0.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with F065-4300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F065-4300?
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What is the minimum amount of F065-4300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F065-4300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F065-4300
  • 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 F065-4300 available by request