Y040-4733 Screening compound: 1-[2-(2-fluoro-6-methoxyphenyl)-5-methyl-1,3-thiazole-4-carbonyl]-4-(3-methoxyphenyl)piperazine

Y040-4733 Screening compound: 1-[2-(2-fluoro-6-methoxyphenyl)-5-methyl-1,3-thiazole-4-carbonyl]-4-(3-methoxyphenyl)piperazine
Y040-4733 Screening compound: 1-[2-(2-fluoro-6-methoxyphenyl)-5-methyl-1,3-thiazole-4-carbonyl]-4-(3-methoxyphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-4733
1-[2-(2-fluoro-6-methoxyphenyl)-5-methyl-1,3-thiazole-4-carbonyl]-4-(3-methoxyphenyl)piperazine

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

Y040-4733

Molecular Formula

C23H24FN3O3S (C23 H24 FN3 O3 S)

Compound Name

1-[2-(2-fluoro-6-methoxyphenyl)-5-methyl-1,3-thiazole-4-carbonyl]-4-(3-methoxyphenyl)piperazine

IUPAC name

1-[2-(2-fluoro-6-methoxyphenyl)-5-methyl-13-thiazole-4-carbonyl]-4-(3-methoxyphenyl)piperazine

SMILES

Cc1c(C(N(CC2)CCN2c2cc(OC)ccc2)=O)nc(-c(c(OC)ccc2)c2F)s1

InChI

InChI=1S/C23H24FN3O3S/c1-15-21(25-22(31-15)20-18(24)8-5-9-19(20)30-3)23(28)27-12-10-26(11-13-27)16-6-4-7-17(14-16)29-2/h4-9,14H,10-13H2,1-3H3

InChI Key

BJWBKDZZKIGZBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10042027

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.270

Distribution Coefficient, logD

4.270

Water Solubility, LogSw

-4.56

Polar Surface Area

45.826

Acid Dissociation Constant (pKa)

27.12

Base Dissociation Constant (pKb)

2.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

Y040-4733 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • 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 Y040-4733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-4733?
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What is the minimum amount of Y040-4733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-4733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-4733
  • 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 Y040-4733 available by request