8174-1331 Screening compound: 1-methyl-9-propyl-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione

8174-1331 Screening compound: 1-methyl-9-propyl-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione
8174-1331 Screening compound: 1-methyl-9-propyl-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 8174-1331
1-methyl-9-propyl-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

8174-1331

Molecular Formula

C12H17N5O2 (C12 H17 N5 O2)

Compound Name

1-methyl-9-propyl-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione

IUPAC name

1-methyl-9-propyl-1H2H3H4H6H7H8H9H-pyrimido[12-g]purine-24-dione

SMILES

CCCN1c2nc(N(C)C(NC3=O)=O)c3n2CCC1

InChI

InChI=1S/C12H17N5O2/c1-3-5-16-6-4-7-17-8-9(13-11(16)17)15(2)12(19)14-10(8)18/h3-7H2,1-2H3,(H,14,18,19)

InChI Key

ATYAXSRZIJKFEF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06750099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

263.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.535

Distribution Coefficient, logD

1.535

Water Solubility, LogSw

-2.03

Polar Surface Area

54.430

Acid Dissociation Constant (pKa)

11.46

Base Dissociation Constant (pKb)

3.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.30

8174-1331 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Fragments Library (11262 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 8174-1331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8174-1331?
Check Price and Availability of 8174-1331, 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 8174-1331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8174-1331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8174-1331
  • 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 8174-1331 available by request