L503-2742 Screening compound: N-(2,4-difluorophenyl)-2-[3,3-dimethyl-5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]acetamide

L503-2742 Screening compound: N-(2,4-difluorophenyl)-2-[3,3-dimethyl-5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]acetamide
L503-2742 Screening compound: N-(2,4-difluorophenyl)-2-[3,3-dimethyl-5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L503-2742
N-(2,4-difluorophenyl)-2-[3,3-dimethyl-5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]acetamide

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

L503-2742

Molecular Formula

C22H25F2N3O3S (C22 H25 F2 N3 O3 S)

Compound Name

N-(2,4-difluorophenyl)-2-[3,3-dimethyl-5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]acetamide

IUPAC name

N-(24-difluorophenyl)-2-[33-dimethyl-5-(pyrrolidine-1-sulfonyl)-23-dihydro-1H-indol-1-yl]acetamide

SMILES

CC1(C)c(cc(cc2)S(N3CCCC3)(=O)=O)c2N(CC(Nc(ccc(F)c2)c2F)=O)C1

InChI

InChI=1S/C22H25F2N3O3S/c1-22(2)14-26(13-21(28)25-19-7-5-15(23)11-18(19)24)20-8-6-16(12-17(20)22)31(29,30)27-9-3-4-10-27/h5-8,11-12H,3-4,9-10,13-14H2,1-2H3,(H,25,28)

InChI Key

YLIMLFTWMXHBKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15129027

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.010

Distribution Coefficient, logD

3.993

Water Solubility, LogSw

-4.17

Polar Surface Area

57.629

Acid Dissociation Constant (pKa)

8.78

Base Dissociation Constant (pKb)

-0.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

L503-2742 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L503-2742 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L503-2742?
Check Price and Availability of L503-2742, 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 L503-2742 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L503-2742
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L503-2742
  • 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 L503-2742 available by request