Y040-4530 Screening compound: 2-(N-methyl4-acetamidobenzenesulfonamido)acetic acid

Y040-4530 Screening compound: 2-(N-methyl4-acetamidobenzenesulfonamido)acetic acid
Y040-4530 Screening compound: 2-(N-methyl4-acetamidobenzenesulfonamido)acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-4530
2-(N-methyl4-acetamidobenzenesulfonamido)acetic acid

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

Y040-4530

Molecular Formula

C11H14N2O5S (C11 H14 N2 O5 S)

Compound Name

2-(N-methyl4-acetamidobenzenesulfonamido)acetic acid

IUPAC name

2-(N-methyl4-acetamidobenzenesulfonamido)acetic acid

SMILES

CC(Nc(cc1)ccc1S(N(C)CC(O)=O)(=O)=O)=O

InChI

InChI=1S/C11H14N2O5S/c1-8(14)12-9-3-5-10(6-4-9)19(17,18)13(2)7-11(15)16/h3-6H,7H2,1-2H3,(H,12,14)(H,15,16)

InChI Key

XSIMQRXFVODVTO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03987301

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

286.31

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.861

Distribution Coefficient, logD

-4.861

Water Solubility, LogSw

-2.11

Polar Surface Area

84.720

Acid Dissociation Constant (pKa)

3.40

Base Dissociation Constant (pKb)

-1.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

Y040-4530 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Integrin Receptors Targeted library (1715 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with Y040-4530 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-4530?
Check Price and Availability of Y040-4530, 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 Y040-4530 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-4530
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-4530
  • 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 Y040-4530 available by request