8396-0107 Screening compound: benzyl 2-[1-(4-butoxybenzoyl)-3-oxopiperazin-2-yl]acetate

8396-0107 Screening compound: benzyl 2-[1-(4-butoxybenzoyl)-3-oxopiperazin-2-yl]acetate
8396-0107 Screening compound: benzyl 2-[1-(4-butoxybenzoyl)-3-oxopiperazin-2-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8396-0107
benzyl 2-[1-(4-butoxybenzoyl)-3-oxopiperazin-2-yl]acetate

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

8396-0107

Molecular Formula

C24H28N2O5 (C24 H28 N2 O5)

Compound Name

benzyl 2-[1-(4-butoxybenzoyl)-3-oxopiperazin-2-yl]acetate

IUPAC name

benzyl 2-[1-(4-butoxybenzoyl)-3-oxopiperazin-2-yl]acetate

SMILES

CCCCOc(cc1)ccc1C(N(CCN1)C(CC(OCc2ccccc2)=O)C1=O)=O

InChI

InChI=1S/C24H28N2O5/c1-2-3-15-30-20-11-9-19(10-12-20)24(29)26-14-13-25-23(28)21(26)16-22(27)31-17-18-7-5-4-6-8-18/h4-12,21H,2-3,13-17H2,1H3,(H,25,28)/t21-/m0/s1

InChI Key

ZFOISGVUVDDMJS-NRFANRHFSA-N

MDL Number (MFCD)

MFCD07128076

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.572

Distribution Coefficient, logD

3.572

Water Solubility, LogSw

-3.51

Polar Surface Area

69.117

Acid Dissociation Constant (pKa)

14.99

Base Dissociation Constant (pKb)

-2.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with 8396-0107 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8396-0107?
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What is the minimum amount of 8396-0107 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8396-0107
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8396-0107
  • 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 8396-0107 available by request