G613-0176 Screening compound: 5-(4-fluorobenzoyl)-3-(4-methoxybenzenesulfonyl)-N2-(3-methoxyphenyl)thiophene-2,4-diamine

G613-0176 Screening compound: 5-(4-fluorobenzoyl)-3-(4-methoxybenzenesulfonyl)-N2-(3-methoxyphenyl)thiophene-2,4-diamine
G613-0176 Screening compound: 5-(4-fluorobenzoyl)-3-(4-methoxybenzenesulfonyl)-N2-(3-methoxyphenyl)thiophene-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound G613-0176
5-(4-fluorobenzoyl)-3-(4-methoxybenzenesulfonyl)-N2-(3-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

G613-0176

Molecular Formula

C25H21FN2O5S2 (C25 H21 FN2 O5 S2)

Compound Name

5-(4-fluorobenzoyl)-3-(4-methoxybenzenesulfonyl)-N2-(3-methoxyphenyl)thiophene-2,4-diamine

IUPAC name

5-(4-fluorobenzoyl)-3-(4-methoxybenzenesulfonyl)-N2-(3-methoxyphenyl)thiophene-24-diamine

SMILES

COc(cc1)ccc1S(c1c(Nc2cc(OC)ccc2)sc(C(c(cc2)ccc2F)=O)c1N)(=O)=O

InChI

InChI=1S/C25H21FN2O5S2/c1-32-18-10-12-20(13-11-18)35(30,31)24-21(27)23(22(29)15-6-8-16(26)9-7-15)34-25(24)28-17-4-3-5-19(14-17)33-2/h3-14,28H,27H2,1-2H3

InChI Key

UQSHPVFIURWFQQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15023124

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.58

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

5.188

Distribution Coefficient, logD

5.188

Water Solubility, LogSw

-5.14

Polar Surface Area

86.387

Acid Dissociation Constant (pKa)

17.58

Base Dissociation Constant (pKb)

-5.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

G613-0176 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 G613-0176 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G613-0176?
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What is the minimum amount of G613-0176 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G613-0176
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G613-0176
  • 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 G613-0176 available by request