L793-4459 Screening compound: 2-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-2-oxo-N-[4-(propan-2-yl)phenyl]acetamide

L793-4459 Screening compound: 2-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-2-oxo-N-[4-(propan-2-yl)phenyl]acetamide
L793-4459 Screening compound: 2-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-2-oxo-N-[4-(propan-2-yl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L793-4459
2-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-2-oxo-N-[4-(propan-2-yl)phenyl]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

L793-4459

Molecular Formula

C22H21FN2O2 (C22 H21 FN2 O2)

Compound Name

2-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-2-oxo-N-[4-(propan-2-yl)phenyl]acetamide

IUPAC name

2-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-2-oxo-N-[4-(propan-2-yl)phenyl]acetamide

SMILES

CC(C)c(cc1)ccc1NC(C(c1cccn1Cc(cc1)ccc1F)=O)=O

InChI

InChI=1S/C22H21FN2O2/c1-15(2)17-7-11-19(12-8-17)24-22(27)21(26)20-4-3-13-25(20)14-16-5-9-18(23)10-6-16/h3-13,15H,14H2,1-2H3,(H,24,27)

InChI Key

NDQFFVXWVNSBEU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27475058

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.293

Distribution Coefficient, logD

5.293

Water Solubility, LogSw

-5.28

Polar Surface Area

38.658

Acid Dissociation Constant (pKa)

10.74

Base Dissociation Constant (pKb)

1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

L793-4459 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with L793-4459 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L793-4459?
Check Price and Availability of L793-4459, 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 L793-4459 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L793-4459
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L793-4459
  • 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 L793-4459 available by request