3379-2180 Screening compound: 4-[(2E)-2-[(2-methoxyphenyl)formamido]-3-phenylprop-2-enamido]benzoic acid

3379-2180 Screening compound: 4-[(2E)-2-[(2-methoxyphenyl)formamido]-3-phenylprop-2-enamido]benzoic acid
3379-2180 Screening compound: 4-[(2E)-2-[(2-methoxyphenyl)formamido]-3-phenylprop-2-enamido]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 3379-2180
4-[(2E)-2-[(2-methoxyphenyl)formamido]-3-phenylprop-2-enamido]benzoic 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

3379-2180

Molecular Formula

C24H20N2O5 (C24 H20 N2 O5)

Compound Name

4-[(2E)-2-[(2-methoxyphenyl)formamido]-3-phenylprop-2-enamido]benzoic acid

IUPAC name

4-[(2E)-2-[(2-methoxyphenyl)formamido]-3-phenylprop-2-enamido]benzoic acid

SMILES

COc(cccc1)c1C(N/C(/C(Nc(cc1)ccc1C(O)=O)=O)=C/c1ccccc1)=O

InChI

InChI=1S/C24H20N2O5/c1-31-21-10-6-5-9-19(21)22(27)26-20(15-16-7-3-2-4-8-16)23(28)25-18-13-11-17(12-14-18)24(29)30/h2-15H,1H3,(H,25,28)(H,26,27)(H,29,30)

InChI Key

SHHVSGFYPPMMQD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02635259

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.43

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

3.953

Distribution Coefficient, logD

1.558

Water Solubility, LogSw

-4.01

Polar Surface Area

81.293

Acid Dissociation Constant (pKa)

5.01

Base Dissociation Constant (pKb)

-2.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.20

3379-2180 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 3379-2180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3379-2180?
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What is the minimum amount of 3379-2180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3379-2180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3379-2180
  • 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 3379-2180 available by request