2290-1670 Screening compound: (2E)-N-(6-bromo-2-oxo-2H-chromen-3-yl)-3-(4-chlorophenyl)prop-2-enamide

2290-1670 Screening compound: (2E)-N-(6-bromo-2-oxo-2H-chromen-3-yl)-3-(4-chlorophenyl)prop-2-enamide
2290-1670 Screening compound: (2E)-N-(6-bromo-2-oxo-2H-chromen-3-yl)-3-(4-chlorophenyl)prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2290-1670
(2E)-N-(6-bromo-2-oxo-2H-chromen-3-yl)-3-(4-chlorophenyl)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

2290-1670

Molecular Formula

C18H11BrClNO3 (C18 H11 BrClNO3)

Compound Name

(2E)-N-(6-bromo-2-oxo-2H-chromen-3-yl)-3-(4-chlorophenyl)prop-2-enamide

IUPAC name

(2E)-N-(6-bromo-2-oxo-2H-chromen-3-yl)-3-(4-chlorophenyl)prop-2-enamide

SMILES

O=C(/C=C/c(cc1)ccc1Cl)NC1=Cc(cc(cc2)Br)c2OC1=O

InChI

InChI=1S/C18H11BrClNO3/c19-13-4-7-16-12(9-13)10-15(18(23)24-16)21-17(22)8-3-11-1-5-14(20)6-2-11/h1-10H,(H,21,22)

InChI Key

HUUDDVAVRPUWME-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01535218

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.65

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.903

Distribution Coefficient, logD

4.862

Water Solubility, LogSw

-5.23

Polar Surface Area

45.001

Acid Dissociation Constant (pKa)

9.91

Base Dissociation Constant (pKb)

6.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

2290-1670 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 2290-1670 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2290-1670?
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What is the minimum amount of 2290-1670 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2290-1670
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2290-1670
  • 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 2290-1670 available by request