G721-0284 Screening compound: methyl 4-[({6-butyl-1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-5-yl}sulfanyl)methyl]benzoate

G721-0284 Screening compound: methyl 4-[({6-butyl-1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-5-yl}sulfanyl)methyl]benzoate
G721-0284 Screening compound: methyl 4-[({6-butyl-1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-5-yl}sulfanyl)methyl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G721-0284
methyl 4-[({6-butyl-1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-5-yl}sulfanyl)methyl]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

G721-0284

Molecular Formula

C22H25N3O4S (C22 H25 N3 O4 S)

Compound Name

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

IUPAC name

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

SMILES

CCCCc(c(SCc(cc1)ccc1C(OC)=O)c1C(N2C)=O)cnc1N(C)C2=O

InChI

InChI=1S/C22H25N3O4S/c1-5-6-7-16-12-23-19-17(20(26)25(3)22(28)24(19)2)18(16)30-13-14-8-10-15(11-9-14)21(27)29-4/h8-12H,5-7,13H2,1-4H3

InChI Key

IKRBFSDEBNWJHZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08326464

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.398

Distribution Coefficient, logD

4.398

Water Solubility, LogSw

-4.42

Polar Surface Area

62.664

Acid Dissociation Constant (pKa)

23.64

Base Dissociation Constant (pKb)

4.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

G721-0284 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 G721-0284 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G721-0284?
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What is the minimum amount of G721-0284 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G721-0284
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G721-0284
  • 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 G721-0284 available by request