Y030-6771 Screening compound: ethyl 1-[2-(phenylsulfanyl)acetyl]-4-piperidinecarboxylate

Y030-6771 Screening compound: ethyl 1-[2-(phenylsulfanyl)acetyl]-4-piperidinecarboxylate
Y030-6771 Screening compound: ethyl 1-[2-(phenylsulfanyl)acetyl]-4-piperidinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-6771
ethyl 1-[2-(phenylsulfanyl)acetyl]-4-piperidinecarboxylate

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

Y030-6771

Molecular Formula

C16H21NO3S (C16 H21 NO3 S)

Compound Name

ethyl 1-[2-(phenylsulfanyl)acetyl]-4-piperidinecarboxylate

IUPAC name

ethyl 1-[2-(phenylsulfanyl)acetyl]piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(CSc1ccccc1)=O)=O

InChI

InChI=1S/C16H21NO3S/c1-2-20-16(19)13-8-10-17(11-9-13)15(18)12-21-14-6-4-3-5-7-14/h3-7,13H,2,8-12H2,1H3

InChI Key

ZRKBEOYTFHXYCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01480881

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

307.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.497

Distribution Coefficient, logD

2.497

Water Solubility, LogSw

-2.35

Polar Surface Area

37.113

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

-0.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

Y030-6771 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y030-6771 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-6771?
Check Price and Availability of Y030-6771, 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 Y030-6771 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-6771
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-6771
  • 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 Y030-6771 available by request