Y050-2522 Screening compound: methyl 2-[1-(ethanesulfonyl)piperidine-4-amido]benzoate

Y050-2522 Screening compound: methyl 2-[1-(ethanesulfonyl)piperidine-4-amido]benzoate
Y050-2522 Screening compound: methyl 2-[1-(ethanesulfonyl)piperidine-4-amido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-2522
methyl 2-[1-(ethanesulfonyl)piperidine-4-amido]benzoate

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

Y050-2522

Molecular Formula

C16H22N2O5S (C16 H22 N2 O5 S)

Compound Name

methyl 2-[1-(ethanesulfonyl)piperidine-4-amido]benzoate

IUPAC name

methyl 2-[1-(ethanesulfonyl)piperidine-4-amido]benzoate

SMILES

CCS(N(CC1)CCC1C(Nc(cccc1)c1C(OC)=O)=O)(=O)=O

InChI

InChI=1S/C16H22N2O5S/c1-3-24(21,22)18-10-8-12(9-11-18)15(19)17-14-7-5-4-6-13(14)16(20)23-2/h4-7,12H,3,8-11H2,1-2H3,(H,17,19)

InChI Key

QUBBDJSIKCSSRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08073087

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.43

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.404

Distribution Coefficient, logD

1.336

Water Solubility, LogSw

-2.46

Polar Surface Area

75.682

Acid Dissociation Constant (pKa)

8.17

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

Y050-2522 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with Y050-2522 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-2522?
Check Price and Availability of Y050-2522, 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 Y050-2522 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-2522
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-2522
  • 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 Y050-2522 available by request