Y050-1826 Screening compound: 1-[1-(3-chloro-4-ethoxybenzenesulfonyl)piperidine-4-carbonyl]-4-methylpiperazine

Y050-1826 Screening compound: 1-[1-(3-chloro-4-ethoxybenzenesulfonyl)piperidine-4-carbonyl]-4-methylpiperazine
Y050-1826 Screening compound: 1-[1-(3-chloro-4-ethoxybenzenesulfonyl)piperidine-4-carbonyl]-4-methylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-1826
1-[1-(3-chloro-4-ethoxybenzenesulfonyl)piperidine-4-carbonyl]-4-methylpiperazine

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

Y050-1826

Molecular Formula

C19H28ClN3O4S (C19 H28 ClN3 O4 S)

Compound Name

1-[1-(3-chloro-4-ethoxybenzenesulfonyl)piperidine-4-carbonyl]-4-methylpiperazine

IUPAC name

1-[1-(3-chloro-4-ethoxybenzenesulfonyl)piperidine-4-carbonyl]-4-methylpiperazine

SMILES

CCOc(ccc(S(N(CC1)CCC1C(N1CCN(C)CC1)=O)(=O)=O)c1)c1Cl

InChI

InChI=1S/C19H28ClN3O4S/c1-3-27-18-5-4-16(14-17(18)20)28(25,26)23-8-6-15(7-9-23)19(24)22-12-10-21(2)11-13-22/h4-5,14-15H,3,6-13H2,1-2H3

InChI Key

KCLIXFPDZIONDQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06752474

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.97

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.763

Distribution Coefficient, logD

1.415

Water Solubility, LogSw

-2.98

Polar Surface Area

59.285

Acid Dissociation Constant (pKa)

23.63

Base Dissociation Constant (pKb)

7.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.20

Y050-1826 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with Y050-1826 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-1826?
Check Price and Availability of Y050-1826, 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 Y050-1826 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-1826
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-1826
  • 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 Y050-1826 available by request