0591-5645 Screening compound: 3,4-dimethyl-N-(1-phenylethyl)benzamide

0591-5645 Screening compound: 3,4-dimethyl-N-(1-phenylethyl)benzamide
0591-5645 Screening compound: 3,4-dimethyl-N-(1-phenylethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0591-5645
3,4-dimethyl-N-(1-phenylethyl)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

0591-5645

Molecular Formula

C17H19NO (C17 H19 NO)

Compound Name

3,4-dimethyl-N-(1-phenylethyl)benzamide

IUPAC name

34-dimethyl-N-(1-phenylethyl)benzamide

SMILES

CC(c1ccccc1)NC(c1cc(C)c(C)cc1)=O

InChI

InChI=1S/C17H19NO/c1-12-9-10-16(11-13(12)2)17(19)18-14(3)15-7-5-4-6-8-15/h4-11,14H,1-3H3,(H,18,19)/t14-/m0/s1

InChI Key

IZQIQRCBLPNYEN-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD00805586

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

253.34

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.932

Distribution Coefficient, logD

3.932

Water Solubility, LogSw

-3.98

Polar Surface Area

23.815

Acid Dissociation Constant (pKa)

11.04

Base Dissociation Constant (pKb)

-3.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.50

0591-5645 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CORONAVIRUS Library (20774 compounds)

Cardiovascular Library (22201 compounds)

Dark Chemical Matter Library (18430 compounds)

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Structure:
  • Pool
Targets:
  • Nuclear receptors

References: we are preparing a list of scientific research reports with 0591-5645 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0591-5645?
Check Price and Availability of 0591-5645, 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 0591-5645 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0591-5645
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0591-5645
  • 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 0591-5645 available by request