G721-0059 Screening compound: methyl 4-(2-{[1,3-dimethyl-2,4-dioxo-6-(propan-2-yl)-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-5-yl]sulfanyl}acetamido)benzoate

G721-0059 Screening compound: methyl 4-(2-{[1,3-dimethyl-2,4-dioxo-6-(propan-2-yl)-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-5-yl]sulfanyl}acetamido)benzoate
G721-0059 Screening compound: methyl 4-(2-{[1,3-dimethyl-2,4-dioxo-6-(propan-2-yl)-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-5-yl]sulfanyl}acetamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G721-0059
methyl 4-(2-{[1,3-dimethyl-2,4-dioxo-6-(propan-2-yl)-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-5-yl]sulfanyl}acetamido)benzoate

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

G721-0059

Molecular Formula

C22H24N4O5S (C22 H24 N4 O5 S)

Compound Name

methyl 4-(2-{[1,3-dimethyl-2,4-dioxo-6-(propan-2-yl)-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-5-yl]sulfanyl}acetamido)benzoate

IUPAC name

methyl 4-(2-{[13-dimethyl-24-dioxo-6-(propan-2-yl)-1H2H3H4H-pyrido[23-d]pyrimidin-5-yl]sulfanyl}acetamido)benzoate

SMILES

CC(C)c(c(SCC(Nc(cc1)ccc1C(OC)=O)=O)c1C(N2C)=O)cnc1N(C)C2=O

InChI

InChI=1S/C22H24N4O5S/c1-12(2)15-10-23-19-17(20(28)26(4)22(30)25(19)3)18(15)32-11-16(27)24-14-8-6-13(7-9-14)21(29)31-5/h6-10,12H,11H2,1-5H3,(H,24,27)

InChI Key

QTMOJQFYQPNKNV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08326238

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.52

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.453

Distribution Coefficient, logD

3.452

Water Solubility, LogSw

-3.75

Polar Surface Area

85.813

Acid Dissociation Constant (pKa)

11.07

Base Dissociation Constant (pKb)

4.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

G721-0059 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 G721-0059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G721-0059?
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What is the minimum amount of G721-0059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G721-0059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G721-0059
  • 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 G721-0059 available by request