C856-0267 Screening compound: 2-(2-benzoyl-1H-pyrrol-1-yl)-N-benzyl-N-ethylacetamide

C856-0267 Screening compound: 2-(2-benzoyl-1H-pyrrol-1-yl)-N-benzyl-N-ethylacetamide
C856-0267 Screening compound: 2-(2-benzoyl-1H-pyrrol-1-yl)-N-benzyl-N-ethylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C856-0267
2-(2-benzoyl-1H-pyrrol-1-yl)-N-benzyl-N-ethylacetamide

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

C856-0267

Molecular Formula

C22H22N2O2 (C22 H22 N2 O2)

Compound Name

2-(2-benzoyl-1H-pyrrol-1-yl)-N-benzyl-N-ethylacetamide

IUPAC name

2-(2-benzoyl-1H-pyrrol-1-yl)-N-benzyl-N-ethylacetamide

SMILES

CCN(Cc1ccccc1)C(Cn1c(C(c2ccccc2)=O)ccc1)=O

InChI

InChI=1S/C22H22N2O2/c1-2-23(16-18-10-5-3-6-11-18)21(25)17-24-15-9-14-20(24)22(26)19-12-7-4-8-13-19/h3-15H,2,16-17H2,1H3

InChI Key

ODROIIYJUPIDRA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14800822

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.834

Distribution Coefficient, logD

3.834

Water Solubility, LogSw

-3.82

Polar Surface Area

30.975

Acid Dissociation Constant (pKa)

21.81

Base Dissociation Constant (pKb)

-0.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

C856-0267 in Drug Discovery

Included in Screening Libraries

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

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C856-0267 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C856-0267?
Check Price and Availability of C856-0267, 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 C856-0267 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C856-0267
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C856-0267
  • 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 C856-0267 available by request