G721-0530 Screening compound: 6-(methoxymethyl)-1,3-dimethyl-5-{[2-(piperidin-1-yl)ethyl]sulfanyl}-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

G721-0530 Screening compound: 6-(methoxymethyl)-1,3-dimethyl-5-{[2-(piperidin-1-yl)ethyl]sulfanyl}-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione
G721-0530 Screening compound: 6-(methoxymethyl)-1,3-dimethyl-5-{[2-(piperidin-1-yl)ethyl]sulfanyl}-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound G721-0530
6-(methoxymethyl)-1,3-dimethyl-5-{[2-(piperidin-1-yl)ethyl]sulfanyl}-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-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

G721-0530

Molecular Formula

C18H26N4O3S (C18 H26 N4 O3 S)

Compound Name

6-(methoxymethyl)-1,3-dimethyl-5-{[2-(piperidin-1-yl)ethyl]sulfanyl}-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

IUPAC name

6-(methoxymethyl)-13-dimethyl-5-{[2-(piperidin-1-yl)ethyl]sulfanyl}-1H2H3H4H-pyrido[23-d]pyrimidine-24-dione

SMILES

CN(c1ncc(COC)c(SCCN2CCCCC2)c1C(N1C)=O)C1=O

InChI

InChI=1S/C18H26N4O3S/c1-20-16-14(17(23)21(2)18(20)24)15(13(11-19-16)12-25-3)26-10-9-22-7-5-4-6-8-22/h11H,4-10,12H2,1-3H3

InChI Key

NXFSVYYWFOTILY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08326885

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.733

Distribution Coefficient, logD

-0.374

Water Solubility, LogSw

-1.98

Polar Surface Area

53.897

Acid Dissociation Constant (pKa)

25.00

Base Dissociation Constant (pKb)

9.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.10

G721-0530 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G721-0530 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of G721-0530 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G721-0530
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G721-0530
  • 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 G721-0530 available by request