V004-8373 Screening compound: 1-(4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-cyclopentylpropan-1-one

V004-8373 Screening compound: 1-(4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-cyclopentylpropan-1-one
V004-8373 Screening compound: 1-(4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-cyclopentylpropan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-8373
1-(4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-cyclopentylpropan-1-one

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

V004-8373

Molecular Formula

C25H33ClN4O (C25 H33 ClN4 O)

Compound Name

1-(4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-cyclopentylpropan-1-one

IUPAC name

1-(4-{5-[(4-chlorophenyl)methyl]-26-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-cyclopentylpropan-1-one

SMILES

Cc1nc(C)nc(N(CC2)CCN2C(CCC2CCCC2)=O)c1Cc(cc1)ccc1Cl

InChI

InChI=1S/C25H33ClN4O/c1-18-23(17-21-7-10-22(26)11-8-21)25(28-19(2)27-18)30-15-13-29(14-16-30)24(31)12-9-20-5-3-4-6-20/h7-8,10-11,20H,3-6,9,12-17H2,1-2H3

InChI Key

CLGHCZFIOSIGEA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19743293

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

441.02

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.266

Distribution Coefficient, logD

5.177

Water Solubility, LogSw

-5.82

Polar Surface Area

38.600

Acid Dissociation Constant (pKa)

20.37

Base Dissociation Constant (pKb)

6.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.00

V004-8373 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with V004-8373 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-8373?
Check Price and Availability of V004-8373, 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 V004-8373 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-8373
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-8373
  • 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 V004-8373 available by request