G751-1203 Screening compound: 5,7-dimethyl-2-{[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]methyl}-1,4-dihydroquinolin-4-one

G751-1203 Screening compound: 5,7-dimethyl-2-{[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]methyl}-1,4-dihydroquinolin-4-one
G751-1203 Screening compound: 5,7-dimethyl-2-{[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]methyl}-1,4-dihydroquinolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G751-1203
5,7-dimethyl-2-{[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]methyl}-1,4-dihydroquinolin-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

G751-1203

Molecular Formula

C17H17N3O2S (C17 H17 N3 O2 S)

Compound Name

5,7-dimethyl-2-{[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]methyl}-1,4-dihydroquinolin-4-one

IUPAC name

57-dimethyl-2-{[(4-methyl-6-oxo-16-dihydropyrimidin-2-yl)sulfanyl]methyl}-14-dihydroquinolin-4-one

SMILES

Cc(cc1C)cc(NC(CSC(N2)=NC(C)=CC2=O)=C2)c1C2=O

InChI

InChI=1S/C17H17N3O2S/c1-9-4-10(2)16-13(5-9)19-12(7-14(16)21)8-23-17-18-11(3)6-15(22)20-17/h4-7H,8H2,1-3H3,(H,19,21)(H,18,20,22)

InChI Key

IYBRZXHNMXLNST-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15031428

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.769

Distribution Coefficient, logD

1.967

Water Solubility, LogSw

-2.99

Polar Surface Area

59.095

Acid Dissociation Constant (pKa)

6.67

Base Dissociation Constant (pKb)

-0.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

G751-1203 in Drug Discovery

Included in Screening Libraries

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G751-1203 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G751-1203?
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What is the minimum amount of G751-1203 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G751-1203
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G751-1203
  • 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 G751-1203 available by request