8010-3352 Screening compound: 4-[3-benzoyl-2-(4-chlorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid

8010-3352 Screening compound: 4-[3-benzoyl-2-(4-chlorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid
8010-3352 Screening compound: 4-[3-benzoyl-2-(4-chlorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-3352
4-[3-benzoyl-2-(4-chlorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid

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

8010-3352

Molecular Formula

C21H18ClNO5 (C21 H18 ClNO5)

Compound Name

4-[3-benzoyl-2-(4-chlorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid

IUPAC name

4-[3-benzoyl-2-(4-chlorophenyl)-4-hydroxy-5-oxo-25-dihydro-1H-pyrrol-1-yl]butanoic acid

SMILES

OC(CCCN(C(C(C(c1ccccc1)=O)=C1O)c(cc2)ccc2Cl)C1=O)=O

InChI

InChI=1S/C21H18ClNO5/c22-15-10-8-13(9-11-15)18-17(19(26)14-5-2-1-3-6-14)20(27)21(28)23(18)12-4-7-16(24)25/h1-3,5-6,8-11,18,27H,4,7,12H2,(H,24,25)/t18-/m1/s1

InChI Key

GXBYQDIATZSRJE-GOSISDBHSA-N

MDL Number (MFCD)

MFCD01871810

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.83

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.363

Distribution Coefficient, logD

-0.458

Water Solubility, LogSw

-3.17

Polar Surface Area

73.461

Acid Dissociation Constant (pKa)

4.58

Base Dissociation Constant (pKb)

-6.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

8010-3352 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8010-3352 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-3352?
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What is the minimum amount of 8010-3352 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-3352
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-3352
  • 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 8010-3352 available by request