8012-5690 Screening compound: 3,4,5-trimethoxy-N-[2-(3-methoxyphenoxy)ethyl]benzamide

8012-5690 Screening compound: 3,4,5-trimethoxy-N-[2-(3-methoxyphenoxy)ethyl]benzamide
8012-5690 Screening compound: 3,4,5-trimethoxy-N-[2-(3-methoxyphenoxy)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-5690
3,4,5-trimethoxy-N-[2-(3-methoxyphenoxy)ethyl]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

8012-5690

Molecular Formula

C19H23NO6 (C19 H23 NO6)

Compound Name

3,4,5-trimethoxy-N-[2-(3-methoxyphenoxy)ethyl]benzamide

IUPAC name

345-trimethoxy-N-[2-(3-methoxyphenoxy)ethyl]benzamide

SMILES

COc1cccc(OCCNC(c(cc2OC)cc(OC)c2OC)=O)c1

InChI

InChI=1S/C19H23NO6/c1-22-14-6-5-7-15(12-14)26-9-8-20-19(21)13-10-16(23-2)18(25-4)17(11-13)24-3/h5-7,10-12H,8-9H2,1-4H3,(H,20,21)

InChI Key

HXPXIJJPFCXMKH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00364291

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.907

Distribution Coefficient, logD

2.907

Water Solubility, LogSw

-3.38

Polar Surface Area

62.433

Acid Dissociation Constant (pKa)

14.93

Base Dissociation Constant (pKb)

-2.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

8012-5690 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 8012-5690 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-5690?
Check Price and Availability of 8012-5690, 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 8012-5690 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-5690
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-5690
  • 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 8012-5690 available by request