P511-0016 Screening compound: ethyl 2-[2-oxo-5-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-1-yl]acetate

P511-0016 Screening compound: ethyl 2-[2-oxo-5-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-1-yl]acetate
P511-0016 Screening compound: ethyl 2-[2-oxo-5-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-1-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound P511-0016
ethyl 2-[2-oxo-5-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-1-yl]acetate

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

P511-0016

Molecular Formula

C13H18N2O5S (C13 H18 N2 O5 S)

Compound Name

ethyl 2-[2-oxo-5-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-1-yl]acetate

IUPAC name

ethyl 2-[2-oxo-5-(pyrrolidine-1-sulfonyl)-12-dihydropyridin-1-yl]acetate

SMILES

CCOC(CN(C=C(C=C1)S(N2CCCC2)(=O)=O)C1=O)=O

InChI

InChI=1S/C13H18N2O5S/c1-2-20-13(17)10-14-9-11(5-6-12(14)16)21(18,19)15-7-3-4-8-15/h5-6,9H,2-4,7-8,10H2,1H3

InChI Key

ZNBAZFBHBAMFDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27577937

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.36

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.149

Distribution Coefficient, logD

0.149

Water Solubility, LogSw

-1.25

Polar Surface Area

69.257

Acid Dissociation Constant (pKa)

25.71

Base Dissociation Constant (pKb)

-3.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

P511-0016 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P511-0016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P511-0016?
Check Price and Availability of P511-0016, 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 P511-0016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P511-0016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P511-0016
  • 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 P511-0016 available by request