2153-0104 Screening compound: 3,4-dichloro-N-[3-methyl-4-(2-oxo-2H-chromen-3-yl)phenyl]benzamide

2153-0104 Screening compound: 3,4-dichloro-N-[3-methyl-4-(2-oxo-2H-chromen-3-yl)phenyl]benzamide
2153-0104 Screening compound: 3,4-dichloro-N-[3-methyl-4-(2-oxo-2H-chromen-3-yl)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2153-0104
3,4-dichloro-N-[3-methyl-4-(2-oxo-2H-chromen-3-yl)phenyl]benzamide

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

2153-0104

Molecular Formula

C23H15Cl2NO3 (C23 H15 Cl2 NO3)

Compound Name

3,4-dichloro-N-[3-methyl-4-(2-oxo-2H-chromen-3-yl)phenyl]benzamide

IUPAC name

34-dichloro-N-[3-methyl-4-(2-oxo-2H-chromen-3-yl)phenyl]benzamide

SMILES

Cc(cc(cc1)NC(c(cc2)cc(Cl)c2Cl)=O)c1C1=Cc(cccc2)c2OC1=O

InChI

InChI=1S/C23H15Cl2NO3/c1-13-10-16(26-22(27)15-6-9-19(24)20(25)12-15)7-8-17(13)18-11-14-4-2-3-5-21(14)29-23(18)28/h2-12H,1H3,(H,26,27)

InChI Key

JENXIXYLBGKPPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01145214

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.28

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

5.899

Distribution Coefficient, logD

5.872

Water Solubility, LogSw

-6.01

Polar Surface Area

43.980

Acid Dissociation Constant (pKa)

8.59

Base Dissociation Constant (pKb)

-4.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

2153-0104 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2153-0104 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2153-0104?
Check Price and Availability of 2153-0104, 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 2153-0104 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2153-0104
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2153-0104
  • 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 2153-0104 available by request