Y030-6801 Screening compound: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(phenylsulfanyl)ethan-1-one

Y030-6801 Screening compound: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(phenylsulfanyl)ethan-1-one
Y030-6801 Screening compound: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(phenylsulfanyl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-6801
1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(phenylsulfanyl)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

Y030-6801

Molecular Formula

C20H24N2OS (C20 H24 N2 OS)

Compound Name

1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(phenylsulfanyl)ethan-1-one

IUPAC name

1-[4-(23-dimethylphenyl)piperazin-1-yl]-2-(phenylsulfanyl)ethan-1-one

SMILES

Cc1cccc(N(CC2)CCN2C(CSc2ccccc2)=O)c1C

InChI

InChI=1S/C20H24N2OS/c1-16-7-6-10-19(17(16)2)21-11-13-22(14-12-21)20(23)15-24-18-8-4-3-5-9-18/h3-10H,11-15H2,1-2H3

InChI Key

BMBAZZZRGPQIJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03576543

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.49

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.344

Distribution Coefficient, logD

4.344

Water Solubility, LogSw

-4.24

Polar Surface Area

19.319

Acid Dissociation Constant (pKa)

25.23

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

Y030-6801 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y030-6801 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-6801?
Check Price and Availability of Y030-6801, 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 Y030-6801 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-6801
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-6801
  • 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 Y030-6801 available by request