G749-0197 Screening compound: 1-cyclopropyl-5,7-dimethyl-2-{[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]sulfanyl}-1H,4H-pyrido[2,3-d]pyrimidin-4-one

G749-0197 Screening compound: 1-cyclopropyl-5,7-dimethyl-2-{[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]sulfanyl}-1H,4H-pyrido[2,3-d]pyrimidin-4-one
G749-0197 Screening compound: 1-cyclopropyl-5,7-dimethyl-2-{[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]sulfanyl}-1H,4H-pyrido[2,3-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G749-0197
1-cyclopropyl-5,7-dimethyl-2-{[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]sulfanyl}-1H,4H-pyrido[2,3-d]pyrimidin-4-one

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

G749-0197

Molecular Formula

C23H24N4O2S (C23 H24 N4 O2 S)

Compound Name

1-cyclopropyl-5,7-dimethyl-2-{[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]sulfanyl}-1H,4H-pyrido[2,3-d]pyrimidin-4-one

IUPAC name

1-cyclopropyl-57-dimethyl-2-{[2-oxo-2-(1234-tetrahydroquinolin-1-yl)ethyl]sulfanyl}-1H4H-pyrido[23-d]pyrimidin-4-one

SMILES

Cc1cc(C)nc(N(C2CC2)C(SCC(N(CCC2)c3c2cccc3)=O)=N2)c1C2=O

InChI

InChI=1S/C23H24N4O2S/c1-14-12-15(2)24-21-20(14)22(29)25-23(27(21)17-9-10-17)30-13-19(28)26-11-5-7-16-6-3-4-8-18(16)26/h3-4,6,8,12,17H,5,7,9-11,13H2,1-2H3

InChI Key

QZTQMZGTFANHCH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15031263

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.54

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

3.983

Distribution Coefficient, logD

3.983

Water Solubility, LogSw

-4.13

Polar Surface Area

49.824

Acid Dissociation Constant (pKa)

26.00

Base Dissociation Constant (pKb)

4.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

G749-0197 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G749-0197 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G749-0197?
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What is the minimum amount of G749-0197 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G749-0197
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G749-0197
  • 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 G749-0197 available by request