Y031-1605 Screening compound: 2-(2-chloro-6-fluorophenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide

Y031-1605 Screening compound: 2-(2-chloro-6-fluorophenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
Y031-1605 Screening compound: 2-(2-chloro-6-fluorophenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-1605
2-(2-chloro-6-fluorophenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide

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

Y031-1605

Molecular Formula

C19H18ClFN2O3 (C19 H18 ClFN2 O3)

Compound Name

2-(2-chloro-6-fluorophenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide

IUPAC name

2-(2-chloro-6-fluorophenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide

SMILES

O=C(Cc(c(F)ccc1)c1Cl)Nc(cccc1)c1C(N1CCOCC1)=O

InChI

InChI=1S/C19H18ClFN2O3/c20-15-5-3-6-16(21)14(15)12-18(24)22-17-7-2-1-4-13(17)19(25)23-8-10-26-11-9-23/h1-7H,8-12H2,(H,22,24)

InChI Key

PRAJSLNYEMJQPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07066808

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.81

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.555

Distribution Coefficient, logD

2.548

Water Solubility, LogSw

-3.58

Polar Surface Area

46.975

Acid Dissociation Constant (pKa)

9.18

Base Dissociation Constant (pKb)

-1.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

Y031-1605 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with Y031-1605 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-1605?
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What is the minimum amount of Y031-1605 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-1605
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-1605
  • 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 Y031-1605 available by request