6049-2956 Screening compound: 4-(2,4-dichlorophenoxy)-1-[4-(2-pyrimidinyl)piperazino]-1-butanone

6049-2956 Screening compound: 4-(2,4-dichlorophenoxy)-1-[4-(2-pyrimidinyl)piperazino]-1-butanone
6049-2956 Screening compound: 4-(2,4-dichlorophenoxy)-1-[4-(2-pyrimidinyl)piperazino]-1-butanone alternative view

Chemical Structure Depiction of ChemDiv screening compound 6049-2956
4-(2,4-dichlorophenoxy)-1-[4-(2-pyrimidinyl)piperazino]-1-butanone

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

6049-2956

Molecular Formula

C18H20Cl2N4O2 (C18 H20 Cl2 N4 O2)

Compound Name

4-(2,4-dichlorophenoxy)-1-[4-(2-pyrimidinyl)piperazino]-1-butanone

IUPAC name

4-(24-dichlorophenoxy)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]butan-1-one

SMILES

O=C(CCCOc(ccc(Cl)c1)c1Cl)N(CC1)CCN1c1ncccn1

InChI

InChI=1S/C18H20Cl2N4O2/c19-14-4-5-16(15(20)13-14)26-12-1-3-17(25)23-8-10-24(11-9-23)18-21-6-2-7-22-18/h2,4-7,13H,1,3,8-12H2

InChI Key

OWQMSDPHCFRUON-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03397687

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.29

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.441

Distribution Coefficient, logD

3.441

Water Solubility, LogSw

-3.61

Polar Surface Area

45.486

Acid Dissociation Constant (pKa)

21.15

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.89

References: we are preparing a list of scientific research reports with 6049-2956 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6049-2956?
Check Price and Availability of 6049-2956, 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 6049-2956 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6049-2956
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6049-2956
  • 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 6049-2956 available by request