P316-0680 Screening compound: 4-cyano-N-[1-(3,5-dimethylphenyl)-2-oxopyrrolidin-3-yl]benzene-1-sulfonamide

P316-0680 Screening compound: 4-cyano-N-[1-(3,5-dimethylphenyl)-2-oxopyrrolidin-3-yl]benzene-1-sulfonamide
P316-0680 Screening compound: 4-cyano-N-[1-(3,5-dimethylphenyl)-2-oxopyrrolidin-3-yl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P316-0680
4-cyano-N-[1-(3,5-dimethylphenyl)-2-oxopyrrolidin-3-yl]benzene-1-sulfonamide

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

P316-0680

Molecular Formula

C19H19N3O3S (C19 H19 N3 O3 S)

Compound Name

4-cyano-N-[1-(3,5-dimethylphenyl)-2-oxopyrrolidin-3-yl]benzene-1-sulfonamide

IUPAC name

4-cyano-N-[1-(35-dimethylphenyl)-2-oxopyrrolidin-3-yl]benzene-1-sulfonamide

SMILES

Cc1cc(N(CCC2NS(c(cc3)ccc3C#N)(=O)=O)C2=O)cc(C)c1

InChI

InChI=1S/C19H19N3O3S/c1-13-9-14(2)11-16(10-13)22-8-7-18(19(22)23)21-26(24,25)17-5-3-15(12-20)4-6-17/h3-6,9-11,18,21H,7-8H2,1-2H3/t18-/m0/s1

InChI Key

NUPHKXXQSFOSAF-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27572470

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.244

Distribution Coefficient, logD

3.244

Water Solubility, LogSw

-3.53

Polar Surface Area

75.728

Acid Dissociation Constant (pKa)

10.66

Base Dissociation Constant (pKb)

-3.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.30

P316-0680 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P316-0680 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P316-0680?
Check Price and Availability of P316-0680, 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 P316-0680 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P316-0680
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P316-0680
  • 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 P316-0680 available by request