V028-0032 Screening compound: 4-(4-cyclohexanecarbonylpiperazin-1-yl)-6-(3,4-difluorophenoxy)pyrimidine

V028-0032 Screening compound: 4-(4-cyclohexanecarbonylpiperazin-1-yl)-6-(3,4-difluorophenoxy)pyrimidine
V028-0032 Screening compound: 4-(4-cyclohexanecarbonylpiperazin-1-yl)-6-(3,4-difluorophenoxy)pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-0032
4-(4-cyclohexanecarbonylpiperazin-1-yl)-6-(3,4-difluorophenoxy)pyrimidine

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

V028-0032

Molecular Formula

C21H24F2N4O2 (C21 H24 F2 N4 O2)

Compound Name

4-(4-cyclohexanecarbonylpiperazin-1-yl)-6-(3,4-difluorophenoxy)pyrimidine

IUPAC name

4-(4-cyclohexanecarbonylpiperazin-1-yl)-6-(34-difluorophenoxy)pyrimidine

SMILES

O=C(C1CCCCC1)N(CC1)CCN1c1cc(Oc(cc2)cc(F)c2F)ncn1

InChI

InChI=1S/C21H24F2N4O2/c22-17-7-6-16(12-18(17)23)29-20-13-19(24-14-25-20)26-8-10-27(11-9-26)21(28)15-4-2-1-3-5-15/h6-7,12-15H,1-5,8-11H2

InChI Key

AKSMLEYAIGEMDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19861019

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

402.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.235

Distribution Coefficient, logD

4.235

Water Solubility, LogSw

-4.25

Polar Surface Area

46.261

Acid Dissociation Constant (pKa)

23.34

Base Dissociation Constant (pKb)

2.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.62

V028-0032 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V028-0032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-0032?
Check Price and Availability of V028-0032, 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 V028-0032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-0032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-0032
  • 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 V028-0032 available by request