P122-0599 Screening compound: N-[1-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-6-methyl-2-oxo-1,2-dihydropyridin-3-yl]benzenesulfonamide

P122-0599 Screening compound: N-[1-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-6-methyl-2-oxo-1,2-dihydropyridin-3-yl]benzenesulfonamide
P122-0599 Screening compound: N-[1-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-6-methyl-2-oxo-1,2-dihydropyridin-3-yl]benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P122-0599
N-[1-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-6-methyl-2-oxo-1,2-dihydropyridin-3-yl]benzenesulfonamide

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

P122-0599

Molecular Formula

C21H25N3O6S (C21 H25 N3 O6 S)

Compound Name

N-[1-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-6-methyl-2-oxo-1,2-dihydropyridin-3-yl]benzenesulfonamide

IUPAC name

N-[1-(2-{14-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-6-methyl-2-oxo-12-dihydropyridin-3-yl]benzenesulfonamide

SMILES

CC(N(CC(N(CC1)CCC11OCCO1)=O)C1=O)=CC=C1NS(c1ccccc1)(=O)=O

InChI

InChI=1S/C21H25N3O6S/c1-16-7-8-18(22-31(27,28)17-5-3-2-4-6-17)20(26)24(16)15-19(25)23-11-9-21(10-12-23)29-13-14-30-21/h2-8,22H,9-15H2,1H3

InChI Key

BSISTZVIRABPGX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29020074

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.51

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.563

Distribution Coefficient, logD

-3.337

Water Solubility, LogSw

-2.38

Polar Surface Area

87.869

Acid Dissociation Constant (pKa)

3.50

Base Dissociation Constant (pKb)

0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

P122-0599 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 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 P122-0599 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P122-0599?
Check Price and Availability of P122-0599, 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 P122-0599 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P122-0599
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P122-0599
  • 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 P122-0599 available by request