D715-2113 Screening compound: N-[4,5-dimethyl-3-(4-methylbenzenesulfonyl)-1-(2-methylpropyl)-1H-pyrrol-2-yl]thiophene-2-carboxamide

D715-2113 Screening compound: N-[4,5-dimethyl-3-(4-methylbenzenesulfonyl)-1-(2-methylpropyl)-1H-pyrrol-2-yl]thiophene-2-carboxamide
D715-2113 Screening compound: N-[4,5-dimethyl-3-(4-methylbenzenesulfonyl)-1-(2-methylpropyl)-1H-pyrrol-2-yl]thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D715-2113
N-[4,5-dimethyl-3-(4-methylbenzenesulfonyl)-1-(2-methylpropyl)-1H-pyrrol-2-yl]thiophene-2-carboxamide

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

D715-2113

Molecular Formula

C22H26N2O3S2 (C22 H26 N2 O3 S2)

Compound Name

N-[4,5-dimethyl-3-(4-methylbenzenesulfonyl)-1-(2-methylpropyl)-1H-pyrrol-2-yl]thiophene-2-carboxamide

IUPAC name

N-[45-dimethyl-3-(4-methylbenzenesulfonyl)-1-(2-methylpropyl)-1H-pyrrol-2-yl]thiophene-2-carboxamide

SMILES

CC(C)Cn(c(C)c1C)c(NC(c2cccs2)=O)c1S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C22H26N2O3S2/c1-14(2)13-24-17(5)16(4)20(21(24)23-22(25)19-7-6-12-28-19)29(26,27)18-10-8-15(3)9-11-18/h6-12,14H,13H2,1-5H3,(H,23,25)

InChI Key

JJDJXIHMWUJKCX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09855880

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.59

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.097

Distribution Coefficient, logD

5.085

Water Solubility, LogSw

-4.77

Polar Surface Area

55.490

Acid Dissociation Constant (pKa)

8.93

Base Dissociation Constant (pKb)

-2.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

D715-2113 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Agro:
  • Agro
Targets:
  • Others
  • GPCR
Mechanism of action:
  • Epigenetic
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D715-2113 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D715-2113?
Check Price and Availability of D715-2113, 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 D715-2113 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D715-2113
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D715-2113
  • 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 D715-2113 available by request