L998-0011 Screening compound: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(3-acetamidophenyl)-5-oxopyrrolidine-3-carboxamide

L998-0011 Screening compound: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(3-acetamidophenyl)-5-oxopyrrolidine-3-carboxamide
L998-0011 Screening compound: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(3-acetamidophenyl)-5-oxopyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L998-0011
N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(3-acetamidophenyl)-5-oxopyrrolidine-3-carboxamide

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

L998-0011

Molecular Formula

C20H17ClF3N3O3 (C20 H17 ClF3 N3 O3)

Compound Name

N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(3-acetamidophenyl)-5-oxopyrrolidine-3-carboxamide

IUPAC name

N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(3-acetamidophenyl)-5-oxopyrrolidine-3-carboxamide

SMILES

CC(Nc1cccc(N(CC(C2)C(Nc(cc3)cc(C(F)(F)F)c3Cl)=O)C2=O)c1)=O

InChI

InChI=1S/C20H17ClF3N3O3/c1-11(28)25-13-3-2-4-15(8-13)27-10-12(7-18(27)29)19(30)26-14-5-6-17(21)16(9-14)20(22,23)24/h2-6,8-9,12H,7,10H2,1H3,(H,25,28)(H,26,30)/t12-/m0/s1

InChI Key

SMDKBFMXPVSROT-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD15138473

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.82

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.278

Distribution Coefficient, logD

2.860

Water Solubility, LogSw

-3.77

Polar Surface Area

63.341

Acid Dissociation Constant (pKa)

7.19

Base Dissociation Constant (pKb)

0.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

L998-0011 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L998-0011 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L998-0011?
Check Price and Availability of L998-0011, 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 L998-0011 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L998-0011
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L998-0011
  • 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 L998-0011 available by request