P198-0168 Screening compound: 6-{[4-(2-ethoxyphenyl)piperazin-1-yl]methyl}-2-(propan-2-yl)-3,4-dihydropyrimidin-4-one

P198-0168 Screening compound: 6-{[4-(2-ethoxyphenyl)piperazin-1-yl]methyl}-2-(propan-2-yl)-3,4-dihydropyrimidin-4-one
P198-0168 Screening compound: 6-{[4-(2-ethoxyphenyl)piperazin-1-yl]methyl}-2-(propan-2-yl)-3,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P198-0168
6-{[4-(2-ethoxyphenyl)piperazin-1-yl]methyl}-2-(propan-2-yl)-3,4-dihydropyrimidin-4-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

P198-0168

Molecular Formula

C20H28N4O2 (C20 H28 N4 O2)

Compound Name

6-{[4-(2-ethoxyphenyl)piperazin-1-yl]methyl}-2-(propan-2-yl)-3,4-dihydropyrimidin-4-one

IUPAC name

6-{[4-(2-ethoxyphenyl)piperazin-1-yl]methyl}-2-(propan-2-yl)-34-dihydropyrimidin-4-one

SMILES

CCOc(cccc1)c1N1CCN(CC(N=C(C(C)C)N2)=CC2=O)CC1

InChI

InChI=1S/C20H28N4O2/c1-4-26-18-8-6-5-7-17(18)24-11-9-23(10-12-24)14-16-13-19(25)22-20(21-16)15(2)3/h5-8,13,15H,4,9-12,14H2,1-3H3,(H,21,22,25)

InChI Key

LHKJQUIHLVTYIM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27569054

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.564

Distribution Coefficient, logD

1.897

Water Solubility, LogSw

-2.93

Polar Surface Area

49.471

Acid Dissociation Constant (pKa)

8.07

Base Dissociation Constant (pKb)

7.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

P198-0168 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with P198-0168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P198-0168?
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What is the minimum amount of P198-0168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P198-0168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P198-0168
  • 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 P198-0168 available by request