8005-2764 Screening compound: 1-(4-methoxyphenyl)-3-{4-[2-(1-pyrrolidinyl)acetyl]piperazino}dihydro-1H-pyrrole-2,5-dione

8005-2764 Screening compound: 1-(4-methoxyphenyl)-3-{4-[2-(1-pyrrolidinyl)acetyl]piperazino}dihydro-1H-pyrrole-2,5-dione
8005-2764 Screening compound: 1-(4-methoxyphenyl)-3-{4-[2-(1-pyrrolidinyl)acetyl]piperazino}dihydro-1H-pyrrole-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-2764
1-(4-methoxyphenyl)-3-{4-[2-(1-pyrrolidinyl)acetyl]piperazino}dihydro-1H-pyrrole-2,5-dione

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

8005-2764

Molecular Formula

C21H28N4O4 (C21 H28 N4 O4)

Compound Name

1-(4-methoxyphenyl)-3-{4-[2-(1-pyrrolidinyl)acetyl]piperazino}dihydro-1H-pyrrole-2,5-dione

IUPAC name

1-(4-methoxyphenyl)-3-{4-[2-(pyrrolidin-1-yl)acetyl]piperazin-1-yl}pyrrolidine-25-dione

SMILES

COc(cc1)ccc1N(C(CC1N(CC2)CCN2C(CN2CCCC2)=O)=O)C1=O

InChI

InChI=1S/C21H28N4O4/c1-29-17-6-4-16(5-7-17)25-19(26)14-18(21(25)28)23-10-12-24(13-11-23)20(27)15-22-8-2-3-9-22/h4-7,18H,2-3,8-15H2,1H3/t18-/m0/s1

InChI Key

HQQZNVPYOAYOAA-SFHVURJKSA-N

MDL Number (MFCD)

MFCD00747995

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-0.295

Distribution Coefficient, logD

-0.656

Water Solubility, LogSw

-1.41

Polar Surface Area

59.831

Acid Dissociation Constant (pKa)

16.99

Base Dissociation Constant (pKb)

7.51

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.14

8005-2764 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8005-2764 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-2764?
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What is the minimum amount of 8005-2764 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-2764
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-2764
  • 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 8005-2764 available by request