5914-0553 Screening compound: N1-(2-CHLOROBENZYL)-3-(2-HYDROXYPHENYL)-3-PHENYLPROPANAMIDE

5914-0553 Screening compound: N1-(2-CHLOROBENZYL)-3-(2-HYDROXYPHENYL)-3-PHENYLPROPANAMIDE
5914-0553 Screening compound: N1-(2-CHLOROBENZYL)-3-(2-HYDROXYPHENYL)-3-PHENYLPROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 5914-0553
N1-(2-CHLOROBENZYL)-3-(2-HYDROXYPHENYL)-3-PHENYLPROPANAMIDE

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

5914-0553

Molecular Formula

C22H20ClNO2 (C22 H20 ClNO2)

Compound Name

N1-(2-CHLOROBENZYL)-3-(2-HYDROXYPHENYL)-3-PHENYLPROPANAMIDE

IUPAC name

n/a

SMILES

Oc1c(C(CC(NCc(cccc2)c2Cl)=O)c2ccccc2)cccc1

InChI

InChI=1S/C22H20ClNO2/c23-20-12-6-4-10-17(20)15-24-22(26)14-19(16-8-2-1-3-9-16)18-11-5-7-13-21(18)25/h1-13,19,25H,14-15H2,(H,24,26)/t19-/m0/s1

InChI Key

ILGDTSKVMUJXEP-IBGZPJMESA-N

MDL Number (MFCD)

MFCD02764320

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.86

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.041

Distribution Coefficient, logD

5.041

Water Solubility, LogSw

-4.74

Polar Surface Area

40.715

Acid Dissociation Constant (pKa)

10.85

Base Dissociation Constant (pKb)

-3.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.64

5914-0553 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 5914-0553 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5914-0553?
Check Price and Availability of 5914-0553, 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 5914-0553 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5914-0553
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5914-0553
  • 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 5914-0553 available by request