Y043-0533 Screening compound: 2-{[2-({2-[5-(benzyloxy)-1H-indol-1-yl]acetyl}amino)acetyl]amino}acetic acid

Y043-0533 Screening compound: 2-{[2-({2-[5-(benzyloxy)-1H-indol-1-yl]acetyl}amino)acetyl]amino}acetic acid
Y043-0533 Screening compound: 2-{[2-({2-[5-(benzyloxy)-1H-indol-1-yl]acetyl}amino)acetyl]amino}acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-0533
2-{[2-({2-[5-(benzyloxy)-1H-indol-1-yl]acetyl}amino)acetyl]amino}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

Y043-0533

Molecular Formula

C21H21N3O5 (C21 H21 N3 O5)

Compound Name

2-{[2-({2-[5-(benzyloxy)-1H-indol-1-yl]acetyl}amino)acetyl]amino}acetic acid

IUPAC name

2-(2-{2-[5-(benzyloxy)-1H-indol-1-yl]acetamido}acetamido)acetic acid

SMILES

OC(CNC(CNC(Cn(cc1)c(cc2)c1cc2OCc1ccccc1)=O)=O)=O

InChI

InChI=1S/C21H21N3O5/c25-19(23-12-21(27)28)11-22-20(26)13-24-9-8-16-10-17(6-7-18(16)24)29-14-15-4-2-1-3-5-15/h1-10H,11-14H2,(H,22,26)(H,23,25)(H,27,28)

InChI Key

XNRTYZZLGGDDFR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16622498

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.766

Distribution Coefficient, logD

-2.162

Water Solubility, LogSw

-2.35

Polar Surface Area

86.903

Acid Dissociation Constant (pKa)

3.47

Base Dissociation Constant (pKb)

-0.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.05

Y043-0533 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
Targets:
  • Others

References: we are preparing a list of scientific research reports with Y043-0533 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-0533?
Check Price and Availability of Y043-0533, 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 Y043-0533 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-0533
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-0533
  • 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 Y043-0533 available by request