3970-1703 Screening compound: 4-[(3E)-3-({5-[4-(ethoxycarbonyl)phenyl]furan-2-yl}methylidene)-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl]-2-hydroxybenzoic acid

3970-1703 Screening compound: 4-[(3E)-3-({5-[4-(ethoxycarbonyl)phenyl]furan-2-yl}methylidene)-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl]-2-hydroxybenzoic acid
3970-1703 Screening compound: 4-[(3E)-3-({5-[4-(ethoxycarbonyl)phenyl]furan-2-yl}methylidene)-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl]-2-hydroxybenzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 3970-1703
4-[(3E)-3-({5-[4-(ethoxycarbonyl)phenyl]furan-2-yl}methylidene)-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl]-2-hydroxybenzoic 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

3970-1703

Molecular Formula

C31H23NO7 (C31 H23 NO7)

Compound Name

4-[(3E)-3-({5-[4-(ethoxycarbonyl)phenyl]furan-2-yl}methylidene)-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl]-2-hydroxybenzoic acid

IUPAC name

4-[(3E)-3-({5-[4-(ethoxycarbonyl)phenyl]furan-2-yl}methylidene)-2-oxo-5-phenyl-23-dihydro-1H-pyrrol-1-yl]-2-hydroxybenzoic acid

SMILES

CCOC(c(cc1)ccc1-c1ccc(/C=C(\C=C(c2ccccc2)N2c(cc3)cc(O)c3C(O)=O)/C2=O)o1)=O

InChI

InChI=1S/C31H23NO7/c1-2-38-31(37)21-10-8-20(9-11-21)28-15-13-24(39-28)16-22-17-26(19-6-4-3-5-7-19)32(29(22)34)23-12-14-25(30(35)36)27(33)18-23/h3-18,33H,2H2,1H3,(H,35,36)

InChI Key

OUBGOQDLWHJWOT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02379516

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

521.53

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

7.046

Distribution Coefficient, logD

4.017

Water Solubility, LogSw

-5.54

Polar Surface Area

88.327

Acid Dissociation Constant (pKa)

4.37

Base Dissociation Constant (pKb)

-3.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.50

3970-1703 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 3970-1703 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3970-1703?
Check Price and Availability of 3970-1703, 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 3970-1703 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3970-1703
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3970-1703
  • 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 3970-1703 available by request