8007-3602 Screening compound: 4-amino-2-[[(benzyloxy)carbonyl](methyl)amino]-4-oxobutanoic acid

8007-3602 Screening compound: 4-amino-2-[[(benzyloxy)carbonyl](methyl)amino]-4-oxobutanoic acid
8007-3602 Screening compound: 4-amino-2-[[(benzyloxy)carbonyl](methyl)amino]-4-oxobutanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-3602
4-amino-2-[[(benzyloxy)carbonyl](methyl)amino]-4-oxobutanoic 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

8007-3602

Molecular Formula

C13H16N2O5 (C13 H16 N2 O5)

Compound Name

4-amino-2-[[(benzyloxy)carbonyl](methyl)amino]-4-oxobutanoic acid

IUPAC name

2-{[(benzyloxy)carbonyl](methyl)amino}-3-carbamoylpropanoic acid

SMILES

CN(C(CC(N)=O)C(O)=O)C(OCc1ccccc1)=O

InChI

InChI=1S/C13H16N2O5/c1-15(10(12(17)18)7-11(14)16)13(19)20-8-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H2,14,16)(H,17,18)/t10-/m0/s1

InChI Key

WYDIYVSIFPKQFO-JTQLQIEISA-N

MDL Number (MFCD)

MFCD01058369

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.28

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.026

Distribution Coefficient, logD

-3.408

Water Solubility, LogSw

-1.29

Polar Surface Area

83.640

Acid Dissociation Constant (pKa)

3.97

Base Dissociation Constant (pKb)

-0.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.77

8007-3602 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8007-3602 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-3602?
Check Price and Availability of 8007-3602, 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 8007-3602 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-3602
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-3602
  • 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 8007-3602 available by request