G070-0006 Screening compound: ethyl 4-({4-[(3,4-dimethoxyphenyl)carbamoyl]piperidin-1-yl}sulfonyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate

G070-0006 Screening compound: ethyl 4-({4-[(3,4-dimethoxyphenyl)carbamoyl]piperidin-1-yl}sulfonyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
G070-0006 Screening compound: ethyl 4-({4-[(3,4-dimethoxyphenyl)carbamoyl]piperidin-1-yl}sulfonyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G070-0006
ethyl 4-({4-[(3,4-dimethoxyphenyl)carbamoyl]piperidin-1-yl}sulfonyl)-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

G070-0006

Molecular Formula

C23H31N3O7S (C23 H31 N3 O7 S)

Compound Name

ethyl 4-({4-[(3,4-dimethoxyphenyl)carbamoyl]piperidin-1-yl}sulfonyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 4-({4-[(34-dimethoxyphenyl)carbamoyl]piperidin-1-yl}sulfonyl)-25-dimethyl-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(C)c1S(N(CC1)CCC1C(Nc(cc1)cc(OC)c1OC)=O)(=O)=O)=O

InChI

InChI=1S/C23H31N3O7S/c1-6-33-23(28)20-14(2)24-15(3)21(20)34(29,30)26-11-9-16(10-12-26)22(27)25-17-7-8-18(31-4)19(13-17)32-5/h7-8,13,16,24H,6,9-12H2,1-5H3,(H,25,27)

InChI Key

XRJPOCJSLBPDJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14978470

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

493.58

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.816

Distribution Coefficient, logD

1.816

Water Solubility, LogSw

-2.70

Polar Surface Area

101.843

Acid Dissociation Constant (pKa)

10.77

Base Dissociation Constant (pKb)

1.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.80

G070-0006 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G070-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G070-0006?
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What is the minimum amount of G070-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G070-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G070-0006
  • 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 G070-0006 available by request