D389-0336 Screening compound: 1-methyl-9-(3-methylphenyl)-3-[2-(piperidin-1-yl)ethyl]-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione

D389-0336 Screening compound: 1-methyl-9-(3-methylphenyl)-3-[2-(piperidin-1-yl)ethyl]-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione
D389-0336 Screening compound: 1-methyl-9-(3-methylphenyl)-3-[2-(piperidin-1-yl)ethyl]-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D389-0336
1-methyl-9-(3-methylphenyl)-3-[2-(piperidin-1-yl)ethyl]-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione

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

D389-0336

Molecular Formula

C23H30N6O2 (C23 H30 N6 O2)

Compound Name

1-methyl-9-(3-methylphenyl)-3-[2-(piperidin-1-yl)ethyl]-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione

IUPAC name

1-methyl-9-(3-methylphenyl)-3-[2-(piperidin-1-yl)ethyl]-1H2H3H4H6H7H8H9H-pyrimido[12-g]purine-24-dione

SMILES

Cc1cccc(N2c3nc(N(C)C(N(CCN4CCCCC4)C4=O)=O)c4n3CCC2)c1

InChI

InChI=1S/C23H30N6O2/c1-17-8-6-9-18(16-17)27-12-7-13-28-19-20(24-22(27)28)25(2)23(31)29(21(19)30)15-14-26-10-4-3-5-11-26/h6,8-9,16H,3-5,7,10-15H2,1-2H3

InChI Key

NMGSCRANPUSVRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04175571

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.557

Distribution Coefficient, logD

1.404

Water Solubility, LogSw

-3.53

Polar Surface Area

48.744

Acid Dissociation Constant (pKa)

21.60

Base Dissociation Constant (pKb)

9.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.20

References: we are preparing a list of scientific research reports with D389-0336 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D389-0336?
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What is the minimum amount of D389-0336 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D389-0336
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D389-0336
  • 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 D389-0336 available by request