Y206-8278 Screening compound: N~1~-(3-chlorobenzyl)-2,4,5-trimethoxybenzamide

Y206-8278 Screening compound: N~1~-(3-chlorobenzyl)-2,4,5-trimethoxybenzamide
Y206-8278 Screening compound: N~1~-(3-chlorobenzyl)-2,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y206-8278
N~1~-(3-chlorobenzyl)-2,4,5-trimethoxybenzamide

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

Y206-8278

Molecular Formula

C17H18ClNO4 (C17 H18 ClNO4)

Compound Name

N~1~-(3-chlorobenzyl)-2,4,5-trimethoxybenzamide

IUPAC name

N-[(3-chlorophenyl)methyl]-245-trimethoxybenzamide

SMILES

COc(cc(c(OC)c1)OC)c1C(NCc1cccc(Cl)c1)=O

InChI

InChI=1S/C17H18ClNO4/c1-21-14-9-16(23-3)15(22-2)8-13(14)17(20)19-10-11-5-4-6-12(18)7-11/h4-9H,10H2,1-3H3,(H,19,20)

InChI Key

KBEJMKUFAVSKRO-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.79

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.714

Distribution Coefficient, logD

3.714

Water Solubility, LogSw

-4.16

Polar Surface Area

47.543

Acid Dissociation Constant (pKa)

11.33

Base Dissociation Constant (pKb)

-4.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.53

Y206-8278 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y206-8278 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y206-8278?
Check Price and Availability of Y206-8278, 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 Y206-8278 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y206-8278
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y206-8278
  • 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 Y206-8278 available by request