L876-0031 Screening compound: N-[(4-ethoxyphenyl)methyl]-3-(N-methylbenzenesulfonamido)thiophene-2-carboxamide

L876-0031 Screening compound: N-[(4-ethoxyphenyl)methyl]-3-(N-methylbenzenesulfonamido)thiophene-2-carboxamide
L876-0031 Screening compound: N-[(4-ethoxyphenyl)methyl]-3-(N-methylbenzenesulfonamido)thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L876-0031
N-[(4-ethoxyphenyl)methyl]-3-(N-methylbenzenesulfonamido)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

L876-0031

Molecular Formula

C21H22N2O4S2 (C21 H22 N2 O4 S2)

Compound Name

N-[(4-ethoxyphenyl)methyl]-3-(N-methylbenzenesulfonamido)thiophene-2-carboxamide

IUPAC name

N-[(4-ethoxyphenyl)methyl]-3-(N-methylbenzenesulfonamido)thiophene-2-carboxamide

SMILES

CCOc1ccc(CNC(c(scc2)c2N(C)S(c2ccccc2)(=O)=O)=O)cc1

InChI

InChI=1S/C21H22N2O4S2/c1-3-27-17-11-9-16(10-12-17)15-22-21(24)20-19(13-14-28-20)23(2)29(25,26)18-7-5-4-6-8-18/h4-14H,3,15H2,1-2H3,(H,22,24)

InChI Key

MGAGCWAFUJSCOY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15135955

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.027

Distribution Coefficient, logD

4.027

Water Solubility, LogSw

-3.97

Polar Surface Area

65.314

Acid Dissociation Constant (pKa)

13.60

Base Dissociation Constant (pKb)

-3.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

L876-0031 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 L876-0031 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L876-0031?
Check Price and Availability of L876-0031, 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 L876-0031 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L876-0031
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L876-0031
  • 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 L876-0031 available by request