3822-1011 Screening compound: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-4-butoxybenzamide

3822-1011 Screening compound: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-4-butoxybenzamide
3822-1011 Screening compound: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-4-butoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3822-1011
N-[4-(4-benzoylpiperazin-1-yl)phenyl]-4-butoxybenzamide

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

3822-1011

Molecular Formula

C28H31N3O3 (C28 H31 N3 O3)

Compound Name

N-[4-(4-benzoylpiperazin-1-yl)phenyl]-4-butoxybenzamide

IUPAC name

N-[4-(4-benzoylpiperazin-1-yl)phenyl]-4-butoxybenzamide

SMILES

CCCCOc(cc1)ccc1C(Nc(cc1)ccc1N(CC1)CCN1C(c1ccccc1)=O)=O

InChI

InChI=1S/C28H31N3O3/c1-2-3-21-34-26-15-9-22(10-16-26)27(32)29-24-11-13-25(14-12-24)30-17-19-31(20-18-30)28(33)23-7-5-4-6-8-23/h4-16H,2-3,17-21H2,1H3,(H,29,32)

InChI Key

QIUDHDKYASAPEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03015998

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.017

Distribution Coefficient, logD

5.017

Water Solubility, LogSw

-4.45

Polar Surface Area

50.656

Acid Dissociation Constant (pKa)

11.34

Base Dissociation Constant (pKb)

2.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

3822-1011 in Drug Discovery

Included in Screening Libraries

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3822-1011 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3822-1011?
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What is the minimum amount of 3822-1011 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3822-1011
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3822-1011
  • 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 3822-1011 available by request