Y040-4927 Screening compound: 4-[2-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carbonyl]-2-phenylmorpholine

Y040-4927 Screening compound: 4-[2-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carbonyl]-2-phenylmorpholine
Y040-4927 Screening compound: 4-[2-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carbonyl]-2-phenylmorpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-4927
4-[2-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carbonyl]-2-phenylmorpholine

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

Y040-4927

Molecular Formula

C21H19ClN2O2S (C21 H19 ClN2 O2 S)

Compound Name

4-[2-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carbonyl]-2-phenylmorpholine

IUPAC name

4-[2-(4-chlorophenyl)-4-methyl-13-thiazole-5-carbonyl]-2-phenylmorpholine

SMILES

Cc1c(C(N2CC(c3ccccc3)OCC2)=O)sc(-c(cc2)ccc2Cl)n1

InChI

InChI=1S/C21H19ClN2O2S/c1-14-19(27-20(23-14)16-7-9-17(22)10-8-16)21(25)24-11-12-26-18(13-24)15-5-3-2-4-6-15/h2-10,18H,11-13H2,1H3/t18-/m0/s1

InChI Key

BMTZXFLTDQSVFB-SFHVURJKSA-N

MDL Number (MFCD)

MFCD12203670

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.91

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

4.874

Distribution Coefficient, logD

4.874

Water Solubility, LogSw

-5.06

Polar Surface Area

34.713

Acid Dissociation Constant (pKa)

25.14

Base Dissociation Constant (pKb)

1.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.80

Y040-4927 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y040-4927 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-4927?
Check Price and Availability of Y040-4927, 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 Y040-4927 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-4927
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-4927
  • 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 Y040-4927 available by request