Y020-2422 Screening compound: 2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-[(2-chlorophenyl)methyl]-6-methyl-3,4-dihydropyrimidin-4-one

Y020-2422 Screening compound: 2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-[(2-chlorophenyl)methyl]-6-methyl-3,4-dihydropyrimidin-4-one
Y020-2422 Screening compound: 2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-[(2-chlorophenyl)methyl]-6-methyl-3,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-2422
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-[(2-chlorophenyl)methyl]-6-methyl-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

Y020-2422

Molecular Formula

C24H25ClN4O3 (C24 H25 ClN4 O3)

Compound Name

2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-[(2-chlorophenyl)methyl]-6-methyl-3,4-dihydropyrimidin-4-one

IUPAC name

2-{4-[(2H-13-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-[(2-chlorophenyl)methyl]-6-methyl-34-dihydropyrimidin-4-one

SMILES

CC(N=C(N1)N2CCN(Cc(cc3)cc4c3OCO4)CC2)=C(Cc(cccc2)c2Cl)C1=O

InChI

InChI=1S/C24H25ClN4O3/c1-16-19(13-18-4-2-3-5-20(18)25)23(30)27-24(26-16)29-10-8-28(9-11-29)14-17-6-7-21-22(12-17)32-15-31-21/h2-7,12H,8-11,13-15H2,1H3,(H,26,27,30)

InChI Key

SWYJLFHIURQQIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08709639

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.94

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.748

Distribution Coefficient, logD

2.339

Water Solubility, LogSw

-4.03

Polar Surface Area

57.993

Acid Dissociation Constant (pKa)

10.33

Base Dissociation Constant (pKb)

8.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with Y020-2422 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-2422?
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What is the minimum amount of Y020-2422 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-2422
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-2422
  • 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 Y020-2422 available by request