Y043-2574 Screening compound: N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-1-oxo-1,2-dihydro-4-isoquinolinecarboxamide

Y043-2574 Screening compound: N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-1-oxo-1,2-dihydro-4-isoquinolinecarboxamide
Y043-2574 Screening compound: N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-1-oxo-1,2-dihydro-4-isoquinolinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-2574
N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-1-oxo-1,2-dihydro-4-isoquinolinecarboxamide

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

Y043-2574

Molecular Formula

C18H15ClN2O2S (C18 H15 ClN2 O2 S)

Compound Name

N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-1-oxo-1,2-dihydro-4-isoquinolinecarboxamide

IUPAC name

N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-1-oxo-12-dihydroisoquinoline-4-carboxamide

SMILES

O=C(C(c1c2cccc1)=CNC2=O)NCCSc(cc1)ccc1Cl

InChI

InChI=1S/C18H15ClN2O2S/c19-12-5-7-13(8-6-12)24-10-9-20-18(23)16-11-21-17(22)15-4-2-1-3-14(15)16/h1-8,11H,9-10H2,(H,20,23)(H,21,22)

InChI Key

GYFFEGYYYCFPTG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20536264

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.85

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.029

Distribution Coefficient, logD

3.018

Water Solubility, LogSw

-3.88

Polar Surface Area

48.988

Acid Dissociation Constant (pKa)

9.01

Base Dissociation Constant (pKb)

1.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.11

References: we are preparing a list of scientific research reports with Y043-2574 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-2574?
Check Price and Availability of Y043-2574, 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 Y043-2574 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-2574
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-2574
  • 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 Y043-2574 available by request