Y050-2555 Screening compound: 1-[1-(ethanesulfonyl)piperidine-4-carbonyl]-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine

Y050-2555 Screening compound: 1-[1-(ethanesulfonyl)piperidine-4-carbonyl]-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine
Y050-2555 Screening compound: 1-[1-(ethanesulfonyl)piperidine-4-carbonyl]-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-2555
1-[1-(ethanesulfonyl)piperidine-4-carbonyl]-4-[(2E)-3-phenylprop-2-en-1-yl]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

Y050-2555

Molecular Formula

C21H31N3O3S (C21 H31 N3 O3 S)

Compound Name

1-[1-(ethanesulfonyl)piperidine-4-carbonyl]-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine

IUPAC name

1-[1-(ethanesulfonyl)piperidine-4-carbonyl]-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine

SMILES

CCS(N(CC1)CCC1C(N1CCN(C/C=C/c2ccccc2)CC1)=O)(=O)=O

InChI

InChI=1S/C21H31N3O3S/c1-2-28(26,27)24-13-10-20(11-14-24)21(25)23-17-15-22(16-18-23)12-6-9-19-7-4-3-5-8-19/h3-9,20H,2,10-18H2,1H3

InChI Key

IZIPTCNTKDXJCT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07403428

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.097

Distribution Coefficient, logD

2.091

Water Solubility, LogSw

-2.43

Polar Surface Area

52.282

Acid Dissociation Constant (pKa)

22.12

Base Dissociation Constant (pKb)

5.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

Y050-2555 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Y050-2555 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-2555?
Check Price and Availability of Y050-2555, 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 Y050-2555 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-2555
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-2555
  • 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 Y050-2555 available by request