2072-0582 Screening compound: 3-methyl-N-[4-(4-propoxybenzamido)phenyl]benzamide

2072-0582 Screening compound: 3-methyl-N-[4-(4-propoxybenzamido)phenyl]benzamide
2072-0582 Screening compound: 3-methyl-N-[4-(4-propoxybenzamido)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2072-0582
3-methyl-N-[4-(4-propoxybenzamido)phenyl]benzamide

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

2072-0582

Molecular Formula

C24H24N2O3 (C24 H24 N2 O3)

Compound Name

3-methyl-N-[4-(4-propoxybenzamido)phenyl]benzamide

IUPAC name

3-methyl-N-[4-(4-propoxybenzamido)phenyl]benzamide

SMILES

CCCOc(cc1)ccc1C(Nc(cc1)ccc1NC(c1cc(C)ccc1)=O)=O

InChI

InChI=1S/C24H24N2O3/c1-3-15-29-22-13-7-18(8-14-22)23(27)25-20-9-11-21(12-10-20)26-24(28)19-6-4-5-17(2)16-19/h4-14,16H,3,15H2,1-2H3,(H,25,27)(H,26,28)

InChI Key

AMMHCCAPYWCRBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01532723

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.182

Distribution Coefficient, logD

5.182

Water Solubility, LogSw

-5.04

Polar Surface Area

53.839

Acid Dissociation Constant (pKa)

10.56

Base Dissociation Constant (pKb)

-0.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

2072-0582 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 2072-0582 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2072-0582?
Check Price and Availability of 2072-0582, 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 2072-0582 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2072-0582
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2072-0582
  • 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 2072-0582 available by request