2280-6878 Screening compound: 1-(4-CHLOROPHENYL)-2-(3,4-DIHYDRO-2H-PYRROL-5-YLAMINO)-1-ETHANONE

2280-6878 Screening compound: 1-(4-CHLOROPHENYL)-2-(3,4-DIHYDRO-2H-PYRROL-5-YLAMINO)-1-ETHANONE
2280-6878 Screening compound: 1-(4-CHLOROPHENYL)-2-(3,4-DIHYDRO-2H-PYRROL-5-YLAMINO)-1-ETHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound 2280-6878
1-(4-CHLOROPHENYL)-2-(3,4-DIHYDRO-2H-PYRROL-5-YLAMINO)-1-ETHANONE

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

2280-6878

Molecular Formula

C12H13ClN2O (C12 H13 ClN2 O)

Compound Name

1-(4-CHLOROPHENYL)-2-(3,4-DIHYDRO-2H-PYRROL-5-YLAMINO)-1-ETHANONE

IUPAC name

n/a

SMILES

O=C(CNC1=NCCC1)c(cc1)ccc1Cl

InChI

InChI=1S/C12H13ClN2O/c13-10-5-3-9(4-6-10)11(16)8-15-12-2-1-7-14-12/h3-6H,1-2,7-8H2,(H,14,15)

InChI Key

IIHBGJLIWSFSTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01123628

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

236.7

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.266

Distribution Coefficient, logD

-1.304

Water Solubility, LogSw

-3.39

Polar Surface Area

34.595

Acid Dissociation Constant (pKa)

16.41

Base Dissociation Constant (pKb)

10.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

2280-6878 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 2280-6878 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2280-6878?
Check Price and Availability of 2280-6878, 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 2280-6878 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2280-6878
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2280-6878
  • 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 2280-6878 available by request