2159-1369 Screening compound: propyl 4-(3,6-dichloro-2-methoxybenzamido)benzoate

2159-1369 Screening compound: propyl 4-(3,6-dichloro-2-methoxybenzamido)benzoate
2159-1369 Screening compound: propyl 4-(3,6-dichloro-2-methoxybenzamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2159-1369
propyl 4-(3,6-dichloro-2-methoxybenzamido)benzoate

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

2159-1369

Molecular Formula

C18H17Cl2NO4 (C18 H17 Cl2 NO4)

Compound Name

propyl 4-(3,6-dichloro-2-methoxybenzamido)benzoate

IUPAC name

propyl 4-(36-dichloro-2-methoxybenzamido)benzoate

SMILES

CCCOC(c(cc1)ccc1NC(c(c(OC)c(cc1)Cl)c1Cl)=O)=O

InChI

InChI=1S/C18H17Cl2NO4/c1-3-10-25-18(23)11-4-6-12(7-5-11)21-17(22)15-13(19)8-9-14(20)16(15)24-2/h4-9H,3,10H2,1-2H3,(H,21,22)

InChI Key

VVJJAMABZXTOCM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01182863

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.254

Distribution Coefficient, logD

4.213

Water Solubility, LogSw

-6.07

Polar Surface Area

52.094

Acid Dissociation Constant (pKa)

6.40

Base Dissociation Constant (pKb)

-3.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

2159-1369 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

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 2159-1369 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2159-1369?
Check Price and Availability of 2159-1369, 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 2159-1369 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2159-1369
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2159-1369
  • 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 2159-1369 available by request