Y031-1184 Screening compound: 1-[(4-chlorophenyl)methanesulfonyl]-4-(furan-2-carbonyl)piperazine

Y031-1184 Screening compound: 1-[(4-chlorophenyl)methanesulfonyl]-4-(furan-2-carbonyl)piperazine
Y031-1184 Screening compound: 1-[(4-chlorophenyl)methanesulfonyl]-4-(furan-2-carbonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-1184
1-[(4-chlorophenyl)methanesulfonyl]-4-(furan-2-carbonyl)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

Y031-1184

Molecular Formula

C16H17ClN2O4S (C16 H17 ClN2 O4 S)

Compound Name

1-[(4-chlorophenyl)methanesulfonyl]-4-(furan-2-carbonyl)piperazine

IUPAC name

1-[(4-chlorophenyl)methanesulfonyl]-4-(furan-2-carbonyl)piperazine

SMILES

O=C(c1ccco1)N(CC1)CCN1S(Cc(cc1)ccc1Cl)(=O)=O

InChI

InChI=1S/C16H17ClN2O4S/c17-14-5-3-13(4-6-14)12-24(21,22)19-9-7-18(8-10-19)16(20)15-2-1-11-23-15/h1-6,11H,7-10,12H2

InChI Key

FWVGHNSSHPIUKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06154284

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.84

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.776

Distribution Coefficient, logD

1.776

Water Solubility, LogSw

-2.57

Polar Surface Area

56.878

Acid Dissociation Constant (pKa)

20.14

Base Dissociation Constant (pKb)

-3.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

Y031-1184 in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with Y031-1184 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-1184?
Check Price and Availability of Y031-1184, 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 Y031-1184 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-1184
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-1184
  • 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 Y031-1184 available by request