D264-0548 Screening compound: 3-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-1-(3,4-dimethoxyphenyl)urea

D264-0548 Screening compound: 3-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-1-(3,4-dimethoxyphenyl)urea
D264-0548 Screening compound: 3-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-1-(3,4-dimethoxyphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound D264-0548
3-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-1-(3,4-dimethoxyphenyl)urea

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

D264-0548

Molecular Formula

C22H28ClN3O3 (C22 H28 ClN3 O3)

Compound Name

3-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-1-(3,4-dimethoxyphenyl)urea

IUPAC name

3-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-1-(34-dimethoxyphenyl)urea

SMILES

COc(ccc(NC(NCC1CCN(Cc(cccc2)c2Cl)CC1)=O)c1)c1OC

InChI

InChI=1S/C22H28ClN3O3/c1-28-20-8-7-18(13-21(20)29-2)25-22(27)24-14-16-9-11-26(12-10-16)15-17-5-3-4-6-19(17)23/h3-8,13,16H,9-12,14-15H2,1-2H3,(H2,24,25,27)

InChI Key

USKZRQPAGJUIFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14815838

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.94

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.976

Distribution Coefficient, logD

2.340

Water Solubility, LogSw

-4.30

Polar Surface Area

52.857

Acid Dissociation Constant (pKa)

12.51

Base Dissociation Constant (pKb)

9.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

D264-0548 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Immune system
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • Receptor's ligands
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with D264-0548 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D264-0548?
Check Price and Availability of D264-0548, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D264-0548 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D264-0548
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D264-0548
  • 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 D264-0548 available by request