G613-0107 Screening compound: 5-(2H-1,3-benzodioxole-5-carbonyl)-3-(4-methylbenzenesulfonyl)-N2-phenylthiophene-2,4-diamine

G613-0107 Screening compound: 5-(2H-1,3-benzodioxole-5-carbonyl)-3-(4-methylbenzenesulfonyl)-N2-phenylthiophene-2,4-diamine
G613-0107 Screening compound: 5-(2H-1,3-benzodioxole-5-carbonyl)-3-(4-methylbenzenesulfonyl)-N2-phenylthiophene-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound G613-0107
5-(2H-1,3-benzodioxole-5-carbonyl)-3-(4-methylbenzenesulfonyl)-N2-phenylthiophene-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

G613-0107

Molecular Formula

C25H20N2O5S2 (C25 H20 N2 O5 S2)

Compound Name

5-(2H-1,3-benzodioxole-5-carbonyl)-3-(4-methylbenzenesulfonyl)-N2-phenylthiophene-2,4-diamine

IUPAC name

5-(2H-13-benzodioxole-5-carbonyl)-3-(4-methylbenzenesulfonyl)-N2-phenylthiophene-24-diamine

SMILES

Cc(cc1)ccc1S(c1c(Nc2ccccc2)sc(C(c(cc2)cc3c2OCO3)=O)c1N)(=O)=O

InChI

InChI=1S/C25H20N2O5S2/c1-15-7-10-18(11-8-15)34(29,30)24-21(26)23(33-25(24)27-17-5-3-2-4-6-17)22(28)16-9-12-19-20(13-16)32-14-31-19/h2-13,27H,14,26H2,1H3

InChI Key

WQRVMHQVAZITKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15023065

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.317

Distribution Coefficient, logD

5.317

Water Solubility, LogSw

-5.42

Polar Surface Area

88.415

Acid Dissociation Constant (pKa)

18.56

Base Dissociation Constant (pKb)

-5.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

G613-0107 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

CNS targets activity set (6557 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • 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 G613-0107 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G613-0107?
Check Price and Availability of G613-0107, 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 G613-0107 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G613-0107
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G613-0107
  • 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 G613-0107 available by request