3701-0247 Screening compound: 1-(3-chlorobenzoyl)-4-[(3-methoxyphenyl)methyl]piperazine

3701-0247 Screening compound: 1-(3-chlorobenzoyl)-4-[(3-methoxyphenyl)methyl]piperazine
3701-0247 Screening compound: 1-(3-chlorobenzoyl)-4-[(3-methoxyphenyl)methyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3701-0247
1-(3-chlorobenzoyl)-4-[(3-methoxyphenyl)methyl]piperazine

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

3701-0247

Molecular Formula

C19H21ClN2O2 (C19 H21 ClN2 O2)

Compound Name

1-(3-chlorobenzoyl)-4-[(3-methoxyphenyl)methyl]piperazine

IUPAC name

1-(3-chlorobenzoyl)-4-[(3-methoxyphenyl)methyl]piperazine

SMILES

COc1cccc(CN(CC2)CCN2C(c2cccc(Cl)c2)=O)c1

InChI

InChI=1S/C19H21ClN2O2/c1-24-18-7-2-4-15(12-18)14-21-8-10-22(11-9-21)19(23)16-5-3-6-17(20)13-16/h2-7,12-13H,8-11,14H2,1H3

InChI Key

DBROALISIWYMDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02177345

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

344.84

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.052

Distribution Coefficient, logD

2.749

Water Solubility, LogSw

-3.40

Polar Surface Area

27.971

Acid Dissociation Constant (pKa)

28.15

Base Dissociation Constant (pKb)

7.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

3701-0247 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Proteases
  • Ion Channels
  • Ion Channels

References: we are preparing a list of scientific research reports with 3701-0247 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3701-0247?
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What is the minimum amount of 3701-0247 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3701-0247
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3701-0247
  • 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 3701-0247 available by request