5929-0167 Screening compound: 2-(diethylamino)ethyl 4-(4-methylbenzamido)benzoate

5929-0167 Screening compound: 2-(diethylamino)ethyl 4-(4-methylbenzamido)benzoate
5929-0167 Screening compound: 2-(diethylamino)ethyl 4-(4-methylbenzamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 5929-0167
2-(diethylamino)ethyl 4-(4-methylbenzamido)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

5929-0167

Molecular Formula

C21H26N2O3 (C21 H26 N2 O3)

Compound Name

2-(diethylamino)ethyl 4-(4-methylbenzamido)benzoate

IUPAC name

2-(diethylamino)ethyl 4-(4-methylbenzamido)benzoate

SMILES

CCN(CC)CCOC(c(cc1)ccc1NC(c1ccc(C)cc1)=O)=O

InChI

InChI=1S/C21H26N2O3/c1-4-23(5-2)14-15-26-21(25)18-10-12-19(13-11-18)22-20(24)17-8-6-16(3)7-9-17/h6-13H,4-5,14-15H2,1-3H3,(H,22,24)

InChI Key

MVISHVPUQTWFAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04070507

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.364

Distribution Coefficient, logD

3.396

Water Solubility, LogSw

-4.02

Polar Surface Area

47.789

Acid Dissociation Constant (pKa)

9.42

Base Dissociation Constant (pKb)

8.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

5929-0167 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with 5929-0167 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5929-0167?
Check Price and Availability of 5929-0167, 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 5929-0167 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5929-0167
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5929-0167
  • 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 5929-0167 available by request