Y040-4669 Screening compound: 2-[2-(2,6-dichlorophenyl)-1,3-thiazol-4-yl]-1-(morpholin-4-yl)ethan-1-one

Y040-4669 Screening compound: 2-[2-(2,6-dichlorophenyl)-1,3-thiazol-4-yl]-1-(morpholin-4-yl)ethan-1-one
Y040-4669 Screening compound: 2-[2-(2,6-dichlorophenyl)-1,3-thiazol-4-yl]-1-(morpholin-4-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-4669
2-[2-(2,6-dichlorophenyl)-1,3-thiazol-4-yl]-1-(morpholin-4-yl)ethan-1-one

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

Y040-4669

Molecular Formula

C15H14Cl2N2O2S (C15 H14 Cl2 N2 O2 S)

Compound Name

2-[2-(2,6-dichlorophenyl)-1,3-thiazol-4-yl]-1-(morpholin-4-yl)ethan-1-one

IUPAC name

2-[2-(26-dichlorophenyl)-13-thiazol-4-yl]-1-(morpholin-4-yl)ethan-1-one

SMILES

O=C(Cc1csc(-c(c(Cl)ccc2)c2Cl)n1)N1CCOCC1

InChI

InChI=1S/C15H14Cl2N2O2S/c16-11-2-1-3-12(17)14(11)15-18-10(9-22-15)8-13(20)19-4-6-21-7-5-19/h1-3,9H,4-8H2

InChI Key

ZDWOBVGEAICBLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10041920

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.26

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.101

Distribution Coefficient, logD

3.101

Water Solubility, LogSw

-3.75

Polar Surface Area

34.497

Acid Dissociation Constant (pKa)

20.61

Base Dissociation Constant (pKb)

-1.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

Y040-4669 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y040-4669 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-4669?
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What is the minimum amount of Y040-4669 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-4669
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-4669
  • 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 Y040-4669 available by request