G613-0018 Screening compound: 3-(benzenesulfonyl)-5-(4-methoxybenzoyl)-N2-(2-methoxyphenyl)thiophene-2,4-diamine

G613-0018 Screening compound: 3-(benzenesulfonyl)-5-(4-methoxybenzoyl)-N2-(2-methoxyphenyl)thiophene-2,4-diamine
G613-0018 Screening compound: 3-(benzenesulfonyl)-5-(4-methoxybenzoyl)-N2-(2-methoxyphenyl)thiophene-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound G613-0018
3-(benzenesulfonyl)-5-(4-methoxybenzoyl)-N2-(2-methoxyphenyl)thiophene-2,4-diamine

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

G613-0018

Molecular Formula

C25H22N2O5S2 (C25 H22 N2 O5 S2)

Compound Name

3-(benzenesulfonyl)-5-(4-methoxybenzoyl)-N2-(2-methoxyphenyl)thiophene-2,4-diamine

IUPAC name

3-(benzenesulfonyl)-5-(4-methoxybenzoyl)-N2-(2-methoxyphenyl)thiophene-24-diamine

SMILES

COc(cc1)ccc1C(c(sc(Nc(cccc1)c1OC)c1S(c2ccccc2)(=O)=O)c1N)=O

InChI

InChI=1S/C25H22N2O5S2/c1-31-17-14-12-16(13-15-17)22(28)23-21(26)24(34(29,30)18-8-4-3-5-9-18)25(33-23)27-19-10-6-7-11-20(19)32-2/h3-15,27H,26H2,1-2H3

InChI Key

NZUJCNCXKOVHJZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15022989

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.59

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.920

Distribution Coefficient, logD

4.920

Water Solubility, LogSw

-4.80

Polar Surface Area

85.776

Acid Dissociation Constant (pKa)

17.11

Base Dissociation Constant (pKb)

-5.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

G613-0018 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G613-0018 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G613-0018?
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What is the minimum amount of G613-0018 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G613-0018
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G613-0018
  • 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 G613-0018 available by request