G749-0034 Screening compound: methyl 2-{[(4-chlorophenyl)methyl]sulfanyl}-1-ethyl-7-methyl-4-oxo-1H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate

G749-0034 Screening compound: methyl 2-{[(4-chlorophenyl)methyl]sulfanyl}-1-ethyl-7-methyl-4-oxo-1H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate
G749-0034 Screening compound: methyl 2-{[(4-chlorophenyl)methyl]sulfanyl}-1-ethyl-7-methyl-4-oxo-1H,4H-pyrido[2,3-d]pyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G749-0034
methyl 2-{[(4-chlorophenyl)methyl]sulfanyl}-1-ethyl-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

G749-0034

Molecular Formula

C19H18ClN3O3S (C19 H18 ClN3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCN(c1c2c(C(OC)=O)cc(C)n1)C(SCc(cc1)ccc1Cl)=NC2=O

InChI

InChI=1S/C19H18ClN3O3S/c1-4-23-16-15(14(18(25)26-3)9-11(2)21-16)17(24)22-19(23)27-10-12-5-7-13(20)8-6-12/h5-9H,4,10H2,1-3H3

InChI Key

LHDXZZLWXMBOTP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12965269

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.89

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

4.005

Distribution Coefficient, logD

4.005

Water Solubility, LogSw

-4.75

Polar Surface Area

56.384

Acid Dissociation Constant (pKa)

28.88

Base Dissociation Constant (pKb)

3.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

G749-0034 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

Targeted Diversity Library (40567 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G749-0034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G749-0034?
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What is the minimum amount of G749-0034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G749-0034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G749-0034
  • 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 G749-0034 available by request