G749-0124 Screening compound: methyl 1-cyclopropyl-2-{[(4-fluorophenyl)methyl]sulfanyl}-7-methyl-4-oxo-1H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate

G749-0124 Screening compound: methyl 1-cyclopropyl-2-{[(4-fluorophenyl)methyl]sulfanyl}-7-methyl-4-oxo-1H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate
G749-0124 Screening compound: methyl 1-cyclopropyl-2-{[(4-fluorophenyl)methyl]sulfanyl}-7-methyl-4-oxo-1H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G749-0124
methyl 1-cyclopropyl-2-{[(4-fluorophenyl)methyl]sulfanyl}-7-methyl-4-oxo-1H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate

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

G749-0124

Molecular Formula

C20H18FN3O3S (C20 H18 FN3 O3 S)

Compound Name

methyl 1-cyclopropyl-2-{[(4-fluorophenyl)methyl]sulfanyl}-7-methyl-4-oxo-1H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate

IUPAC name

methyl 1-cyclopropyl-2-{[(4-fluorophenyl)methyl]sulfanyl}-7-methyl-4-oxo-1H4H-pyrido[23-d]pyrimidine-5-carboxylate

SMILES

Cc(cc1C(OC)=O)nc(N(C2CC2)C(SCc(cc2)ccc2F)=N2)c1C2=O

InChI

InChI=1S/C20H18FN3O3S/c1-11-9-15(19(26)27-2)16-17(22-11)24(14-7-8-14)20(23-18(16)25)28-10-12-3-5-13(21)6-4-12/h3-6,9,14H,7-8,10H2,1-2H3

InChI Key

XQBHMGMHILTVPU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09779427

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.608

Distribution Coefficient, logD

3.608

Water Solubility, LogSw

-3.95

Polar Surface Area

55.940

Acid Dissociation Constant (pKa)

26.52

Base Dissociation Constant (pKb)

3.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

G749-0124 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with G749-0124 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G749-0124?
Check Price and Availability of G749-0124, 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 G749-0124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G749-0124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G749-0124
  • 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 G749-0124 available by request