G070-0532 Screening compound: ethyl 4-{[2-(4-benzylpiperidin-1-yl)-2-oxoethyl](methyl)sulfamoyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate

G070-0532 Screening compound: ethyl 4-{[2-(4-benzylpiperidin-1-yl)-2-oxoethyl](methyl)sulfamoyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
G070-0532 Screening compound: ethyl 4-{[2-(4-benzylpiperidin-1-yl)-2-oxoethyl](methyl)sulfamoyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G070-0532
ethyl 4-{[2-(4-benzylpiperidin-1-yl)-2-oxoethyl](methyl)sulfamoyl}-2,5-dimethyl-1H-pyrrole-3-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

G070-0532

Molecular Formula

C24H33N3O5S (C24 H33 N3 O5 S)

Compound Name

ethyl 4-{[2-(4-benzylpiperidin-1-yl)-2-oxoethyl](methyl)sulfamoyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 4-{[2-(4-benzylpiperidin-1-yl)-2-oxoethyl](methyl)sulfamoyl}-25-dimethyl-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(C)c1S(N(C)CC(N1CCC(Cc2ccccc2)CC1)=O)(=O)=O)=O

InChI

InChI=1S/C24H33N3O5S/c1-5-32-24(29)22-17(2)25-18(3)23(22)33(30,31)26(4)16-21(28)27-13-11-20(12-14-27)15-19-9-7-6-8-10-19/h6-10,20,25H,5,11-16H2,1-4H3

InChI Key

XOJOKYIBCYCYCR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14978664

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.61

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

3.085

Distribution Coefficient, logD

3.085

Water Solubility, LogSw

-3.37

Polar Surface Area

80.465

Acid Dissociation Constant (pKa)

14.15

Base Dissociation Constant (pKb)

-0.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

G070-0532 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G070-0532 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G070-0532?
Check Price and Availability of G070-0532, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G070-0532 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G070-0532
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G070-0532
  • 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 G070-0532 available by request