Y031-6131 Screening compound: 3-benzamido-N-(3-methoxyphenyl)-4-methylbenzamide

Y031-6131 Screening compound: 3-benzamido-N-(3-methoxyphenyl)-4-methylbenzamide
Y031-6131 Screening compound: 3-benzamido-N-(3-methoxyphenyl)-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-6131
3-benzamido-N-(3-methoxyphenyl)-4-methylbenzamide

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

Y031-6131

Molecular Formula

C22H20N2O3 (C22 H20 N2 O3)

Compound Name

3-benzamido-N-(3-methoxyphenyl)-4-methylbenzamide

IUPAC name

3-benzamido-N-(3-methoxyphenyl)-4-methylbenzamide

SMILES

Cc(ccc(C(Nc1cc(OC)ccc1)=O)c1)c1NC(c1ccccc1)=O

InChI

InChI=1S/C22H20N2O3/c1-15-11-12-17(22(26)23-18-9-6-10-19(14-18)27-2)13-20(15)24-21(25)16-7-4-3-5-8-16/h3-14H,1-2H3,(H,23,26)(H,24,25)

InChI Key

DDDLZPDXOOKGNX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09460517

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.094

Distribution Coefficient, logD

4.092

Water Solubility, LogSw

-4.31

Polar Surface Area

53.267

Acid Dissociation Constant (pKa)

9.96

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

Y031-6131 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with Y031-6131 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-6131?
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What is the minimum amount of Y031-6131 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-6131
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-6131
  • 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 Y031-6131 available by request