8010-2277 Screening compound: 4-acetyl-1-(4-fluorophenyl)-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one

8010-2277 Screening compound: 4-acetyl-1-(4-fluorophenyl)-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
8010-2277 Screening compound: 4-acetyl-1-(4-fluorophenyl)-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-2277
4-acetyl-1-(4-fluorophenyl)-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-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

8010-2277

Molecular Formula

C18H13FN2O5 (C18 H13 FN2 O5)

Compound Name

4-acetyl-1-(4-fluorophenyl)-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one

IUPAC name

4-acetyl-1-(4-fluorophenyl)-3-hydroxy-5-(4-nitrophenyl)-25-dihydro-1H-pyrrol-2-one

SMILES

CC(C(C(c(cc1)ccc1[N+]([O-])=O)N(C1=O)c(cc2)ccc2F)=C1O)=O

InChI

InChI=1S/C18H13FN2O5/c1-10(22)15-16(11-2-6-14(7-3-11)21(25)26)20(18(24)17(15)23)13-8-4-12(19)5-9-13/h2-9,16,23H,1H3/t16-/m1/s1

InChI Key

JTWMEZCLGMHEKM-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD01872702

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.31

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.310

Distribution Coefficient, logD

2.309

Water Solubility, LogSw

-2.56

Polar Surface Area

77.957

Acid Dissociation Constant (pKa)

9.76

Base Dissociation Constant (pKb)

-4.03

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

11.11

8010-2277 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 8010-2277 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-2277?
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What is the minimum amount of 8010-2277 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-2277
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-2277
  • 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 8010-2277 available by request