V028-6266 Screening compound: 4-(4-{[benzyl(ethyl)amino]methyl}-6-oxo-1,6-dihydro-2-pyrimidinyl)-N~1~-(3-chlorophenyl)tetrahydro-1(2H)-pyrazinecarboxamide

V028-6266 Screening compound: 4-(4-{[benzyl(ethyl)amino]methyl}-6-oxo-1,6-dihydro-2-pyrimidinyl)-N~1~-(3-chlorophenyl)tetrahydro-1(2H)-pyrazinecarboxamide
V028-6266 Screening compound: 4-(4-{[benzyl(ethyl)amino]methyl}-6-oxo-1,6-dihydro-2-pyrimidinyl)-N~1~-(3-chlorophenyl)tetrahydro-1(2H)-pyrazinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-6266
4-(4-{[benzyl(ethyl)amino]methyl}-6-oxo-1,6-dihydro-2-pyrimidinyl)-N~1~-(3-chlorophenyl)tetrahydro-1(2H)-pyrazinecarboxamide

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

V028-6266

Molecular Formula

C25H29ClN6O2 (C25 H29 ClN6 O2)

Compound Name

4-(4-{[benzyl(ethyl)amino]methyl}-6-oxo-1,6-dihydro-2-pyrimidinyl)-N~1~-(3-chlorophenyl)tetrahydro-1(2H)-pyrazinecarboxamide

IUPAC name

n/a

SMILES

CCN(Cc1ccccc1)CC(N=C(N1)N(CC2)CCN2C(Nc2cccc(Cl)c2)=O)=CC1=O

InChI

InChI=1S/C25H29ClN6O2/c1-2-30(17-19-7-4-3-5-8-19)18-22-16-23(33)29-24(27-22)31-11-13-32(14-12-31)25(34)28-21-10-6-9-20(26)15-21/h3-10,15-16H,2,11-14,17-18H2,1H3,(H,28,34)(H,27,29,33)

InChI Key

BJGTUMZEALGUDG-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

481

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.519

Distribution Coefficient, logD

0.849

Water Solubility, LogSw

-3.65

Polar Surface Area

67.076

Acid Dissociation Constant (pKa)

8.87

Base Dissociation Constant (pKb)

9.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

V028-6266 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V028-6266 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-6266?
Check Price and Availability of V028-6266, 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 V028-6266 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-6266
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-6266
  • 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 V028-6266 available by request