3631-0149 Screening compound: 2-[(2Z)-2-[(furan-2-yl)formamido]-3-phenylprop-2-enamido]-3-methylbutanoic acid

3631-0149 Screening compound: 2-[(2Z)-2-[(furan-2-yl)formamido]-3-phenylprop-2-enamido]-3-methylbutanoic acid
3631-0149 Screening compound: 2-[(2Z)-2-[(furan-2-yl)formamido]-3-phenylprop-2-enamido]-3-methylbutanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 3631-0149
2-[(2Z)-2-[(furan-2-yl)formamido]-3-phenylprop-2-enamido]-3-methylbutanoic 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

3631-0149

Molecular Formula

C19H20N2O5 (C19 H20 N2 O5)

Compound Name

2-[(2Z)-2-[(furan-2-yl)formamido]-3-phenylprop-2-enamido]-3-methylbutanoic acid

IUPAC name

2-[(2Z)-2-[(furan-2-yl)formamido]-3-phenylprop-2-enamido]-3-methylbutanoic acid

SMILES

CC(C)C(C(O)=O)NC(/C(/NC(c1ccco1)=O)=C/c1ccccc1)=O

InChI

InChI=1S/C19H20N2O5/c1-12(2)16(19(24)25)21-17(22)14(11-13-7-4-3-5-8-13)20-18(23)15-9-6-10-26-15/h3-12,16H,1-2H3,(H,20,23)(H,21,22)(H,24,25)/t16-/m0/s1

InChI Key

LVCQXRXPNQGPBM-INIZCTEOSA-N

MDL Number (MFCD)

MFCD03826594

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.100

Distribution Coefficient, logD

-2.236

Water Solubility, LogSw

-1.63

Polar Surface Area

83.186

Acid Dissociation Constant (pKa)

4.06

Base Dissociation Constant (pKb)

-2.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.10

3631-0149 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 3631-0149 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3631-0149?
Check Price and Availability of 3631-0149, 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 3631-0149 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3631-0149
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3631-0149
  • 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 3631-0149 available by request