1683-6932 Screening compound: ethyl 2-(adamantane-1-amido)benzoate

1683-6932 Screening compound: ethyl 2-(adamantane-1-amido)benzoate
1683-6932 Screening compound: ethyl 2-(adamantane-1-amido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1683-6932
ethyl 2-(adamantane-1-amido)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

1683-6932

Molecular Formula

C20H25NO3 (C20 H25 NO3)

Compound Name

ethyl 2-(adamantane-1-amido)benzoate

IUPAC name

ethyl 2-(adamantane-1-amido)benzoate

SMILES

CCOC(c(cccc1)c1NC(C1(CC(C2)C3)CC3CC2C1)=O)=O

InChI

InChI=1S/C20H25NO3/c1-2-24-18(22)16-5-3-4-6-17(16)21-19(23)20-10-13-7-14(11-20)9-15(8-13)12-20/h3-6,13-15H,2,7-12H2,1H3,(H,21,23)

InChI Key

DZTAJGBADYJNRE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00666990

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.174

Distribution Coefficient, logD

5.004

Water Solubility, LogSw

-5.10

Polar Surface Area

43.419

Acid Dissociation Constant (pKa)

7.72

Base Dissociation Constant (pKb)

-2.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

1683-6932 in Drug Discovery

Included in Screening Libraries

CNS Annotated Library (688 compounds)

Cardiovascular Library (22201 compounds)

Human GPCR Annotated Library (5539 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 1683-6932 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1683-6932?
Check Price and Availability of 1683-6932, 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 1683-6932 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1683-6932
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1683-6932
  • 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 1683-6932 available by request