8008-9512 Screening compound: 5-[4-(dimethylamino)phenyl]-1-(4-fluorophenyl)-3-[(4-fluorophenyl)amino]-2,5-dihydro-1H-pyrrol-2-one

8008-9512 Screening compound: 5-[4-(dimethylamino)phenyl]-1-(4-fluorophenyl)-3-[(4-fluorophenyl)amino]-2,5-dihydro-1H-pyrrol-2-one
8008-9512 Screening compound: 5-[4-(dimethylamino)phenyl]-1-(4-fluorophenyl)-3-[(4-fluorophenyl)amino]-2,5-dihydro-1H-pyrrol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-9512
5-[4-(dimethylamino)phenyl]-1-(4-fluorophenyl)-3-[(4-fluorophenyl)amino]-2,5-dihydro-1H-pyrrol-2-one

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

8008-9512

Molecular Formula

C24H21F2N3O (C24 H21 F2 N3 O)

Compound Name

5-[4-(dimethylamino)phenyl]-1-(4-fluorophenyl)-3-[(4-fluorophenyl)amino]-2,5-dihydro-1H-pyrrol-2-one

IUPAC name

5-[4-(dimethylamino)phenyl]-1-(4-fluorophenyl)-3-[(4-fluorophenyl)amino]-25-dihydro-1H-pyrrol-2-one

SMILES

CN(C)c1ccc(C(C=C(C2=O)Nc(cc3)ccc3F)N2c(cc2)ccc2F)cc1

InChI

InChI=1S/C24H21F2N3O/c1-28(2)20-11-3-16(4-12-20)23-15-22(27-19-9-5-17(25)6-10-19)24(30)29(23)21-13-7-18(26)8-14-21/h3-15,23,27H,1-2H3/t23-/m0/s1

InChI Key

SFZJKRIWSAYVGE-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD01335288

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.45

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.977

Distribution Coefficient, logD

4.963

Water Solubility, LogSw

-4.62

Polar Surface Area

28.534

Acid Dissociation Constant (pKa)

12.08

Base Dissociation Constant (pKb)

5.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.50

8008-9512 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8008-9512 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-9512?
Check Price and Availability of 8008-9512, 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 8008-9512 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-9512
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-9512
  • 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 8008-9512 available by request