G751-1672 Screening compound: ethyl 4-oxo-2-{[({[3-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]methyl}-1,4-dihydroquinoline-6-carboxylate

G751-1672 Screening compound: ethyl 4-oxo-2-{[({[3-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]methyl}-1,4-dihydroquinoline-6-carboxylate
G751-1672 Screening compound: ethyl 4-oxo-2-{[({[3-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]methyl}-1,4-dihydroquinoline-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G751-1672
ethyl 4-oxo-2-{[({[3-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]methyl}-1,4-dihydroquinoline-6-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

G751-1672

Molecular Formula

C22H19F3N2O4S (C22 H19 F3 N2 O4 S)

Compound Name

ethyl 4-oxo-2-{[({[3-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]methyl}-1,4-dihydroquinoline-6-carboxylate

IUPAC name

ethyl 4-oxo-2-{[({[3-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]methyl}-14-dihydroquinoline-6-carboxylate

SMILES

CCOC(c(cc1)cc2c1NC(CSCC(Nc1cc(C(F)(F)F)ccc1)=O)=CC2=O)=O

InChI

InChI=1S/C22H19F3N2O4S/c1-2-31-21(30)13-6-7-18-17(8-13)19(28)10-16(26-18)11-32-12-20(29)27-15-5-3-4-14(9-15)22(23,24)25/h3-10H,2,11-12H2,1H3,(H,26,28)(H,27,29)

InChI Key

DTLPVLAEPYEZCX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15031508

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.455

Distribution Coefficient, logD

5.264

Water Solubility, LogSw

-5.50

Polar Surface Area

68.665

Acid Dissociation Constant (pKa)

7.66

Base Dissociation Constant (pKb)

-1.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

G751-1672 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with G751-1672 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G751-1672?
Check Price and Availability of G751-1672, 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 G751-1672 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G751-1672
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G751-1672
  • 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 G751-1672 available by request