G721-0539 Screening compound: 5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-6-(methoxymethyl)-1,3-dimethyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione

G721-0539 Screening compound: 5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-6-(methoxymethyl)-1,3-dimethyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione
G721-0539 Screening compound: 5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-6-(methoxymethyl)-1,3-dimethyl-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound G721-0539
5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-6-(methoxymethyl)-1,3-dimethyl-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

G721-0539

Molecular Formula

C20H23N3O3S (C20 H23 N3 O3 S)

Compound Name

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

IUPAC name

5-{[(25-dimethylphenyl)methyl]sulfanyl}-6-(methoxymethyl)-13-dimethyl-1H2H3H4H-pyrido[23-d]pyrimidine-24-dione

SMILES

Cc1cc(CSc(c(COC)cnc2N(C)C(N3C)=O)c2C3=O)c(C)cc1

InChI

InChI=1S/C20H23N3O3S/c1-12-6-7-13(2)14(8-12)11-27-17-15(10-26-5)9-21-18-16(17)19(24)23(4)20(25)22(18)3/h6-9H,10-11H2,1-5H3

InChI Key

FRTNXGZRLYYSLM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08326894

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.945

Distribution Coefficient, logD

3.945

Water Solubility, LogSw

-3.96

Polar Surface Area

49.914

Acid Dissociation Constant (pKa)

25.00

Base Dissociation Constant (pKb)

3.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

G721-0539 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G721-0539 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of G721-0539 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G721-0539
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G721-0539
  • 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 G721-0539 available by request