Y050-3057 Screening compound: N-cyclopropyl-4-ethoxy-3-methylbenzamide

Y050-3057 Screening compound: N-cyclopropyl-4-ethoxy-3-methylbenzamide
Y050-3057 Screening compound: N-cyclopropyl-4-ethoxy-3-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-3057
N-cyclopropyl-4-ethoxy-3-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

Y050-3057

Molecular Formula

C13H17NO2 (C13 H17 NO2)

Compound Name

N-cyclopropyl-4-ethoxy-3-methylbenzamide

IUPAC name

N-cyclopropyl-4-ethoxy-3-methylbenzamide

SMILES

CCOc(cc1)c(C)cc1C(NC1CC1)=O

InChI

InChI=1S/C13H17NO2/c1-3-16-12-7-4-10(8-9(12)2)13(15)14-11-5-6-11/h4,7-8,11H,3,5-6H2,1-2H3,(H,14,15)

InChI Key

WQYCQSMZTXSTMG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09670976

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

219.28

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.491

Distribution Coefficient, logD

2.491

Water Solubility, LogSw

-2.74

Polar Surface Area

31.918

Acid Dissociation Constant (pKa)

12.10

Base Dissociation Constant (pKb)

-2.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

Y050-3057 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y050-3057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-3057?
Check Price and Availability of Y050-3057, 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 Y050-3057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-3057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-3057
  • 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 Y050-3057 available by request