G751-2945 Screening compound: N-(5-{[(7-methyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide

G751-2945 Screening compound: N-(5-{[(7-methyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide
G751-2945 Screening compound: N-(5-{[(7-methyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G751-2945
N-(5-{[(7-methyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide

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

G751-2945

Molecular Formula

C17H18N4O2S2 (C17 H18 N4 O2 S2)

Compound Name

N-(5-{[(7-methyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide

IUPAC name

N-(5-{[(7-methyl-4-oxo-14-dihydroquinolin-2-yl)methyl]sulfanyl}-134-thiadiazol-2-yl)butanamide

SMILES

CCCC(Nc1nnc(SCC(Nc2c3ccc(C)c2)=CC3=O)s1)=O

InChI

InChI=1S/C17H18N4O2S2/c1-3-4-15(23)19-16-20-21-17(25-16)24-9-11-8-14(22)12-6-5-10(2)7-13(12)18-11/h5-8H,3-4,9H2,1-2H3,(H,18,22)(H,19,20,23)

InChI Key

YEZCBRLLUQBRIV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15031653

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.565

Distribution Coefficient, logD

3.562

Water Solubility, LogSw

-3.68

Polar Surface Area

70.817

Acid Dissociation Constant (pKa)

9.55

Base Dissociation Constant (pKb)

0.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

G751-2945 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human Kinases Annotated Library (2415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G751-2945 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G751-2945?
Check Price and Availability of G751-2945, 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 G751-2945 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G751-2945
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G751-2945
  • 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 G751-2945 available by request