2381-1037 Screening compound: (2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-cyano-N-(2-hydroxyphenyl)prop-2-enamide

2381-1037 Screening compound: (2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-cyano-N-(2-hydroxyphenyl)prop-2-enamide
2381-1037 Screening compound: (2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-cyano-N-(2-hydroxyphenyl)prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2381-1037
(2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-cyano-N-(2-hydroxyphenyl)prop-2-enamide

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

2381-1037

Molecular Formula

C20H13BrN2O3 (C20 H13 BrN2 O3)

Compound Name

(2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-cyano-N-(2-hydroxyphenyl)prop-2-enamide

IUPAC name

(2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-cyano-N-(2-hydroxyphenyl)prop-2-enamide

SMILES

N#C/C(/C(Nc(cccc1)c1O)=O)=C\c1ccc(-c(cc2)ccc2Br)o1

InChI

InChI=1S/C20H13BrN2O3/c21-15-7-5-13(6-8-15)19-10-9-16(26-19)11-14(12-22)20(25)23-17-3-1-2-4-18(17)24/h1-11,24H,(H,23,25)

InChI Key

WWVFKPWGVKLILY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01460969

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.24

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.301

Distribution Coefficient, logD

5.291

Water Solubility, LogSw

-5.37

Polar Surface Area

63.806

Acid Dissociation Constant (pKa)

9.01

Base Dissociation Constant (pKb)

-0.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

2381-1037 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

KRAS-Targeted Library (16000 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 2381-1037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2381-1037?
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What is the minimum amount of 2381-1037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2381-1037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2381-1037
  • 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 2381-1037 available by request