1185-1970 Screening compound: ethyl 2-(3-ethoxy-3-oxopropanamido)benzoate

1185-1970 Screening compound: ethyl 2-(3-ethoxy-3-oxopropanamido)benzoate
1185-1970 Screening compound: ethyl 2-(3-ethoxy-3-oxopropanamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1185-1970
ethyl 2-(3-ethoxy-3-oxopropanamido)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

1185-1970

Molecular Formula

C14H17NO5 (C14 H17 NO5)

Compound Name

ethyl 2-(3-ethoxy-3-oxopropanamido)benzoate

IUPAC name

ethyl 2-(3-ethoxy-3-oxopropanamido)benzoate

SMILES

CCOC(CC(Nc(cccc1)c1C(OCC)=O)=O)=O

InChI

InChI=1S/C14H17NO5/c1-3-19-13(17)9-12(16)15-11-8-6-5-7-10(11)14(18)20-4-2/h5-8H,3-4,9H2,1-2H3,(H,15,16)

InChI Key

FSMBROCPZBVFJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00572626

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

279.29

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.797

Distribution Coefficient, logD

1.774

Water Solubility, LogSw

-2.54

Polar Surface Area

63.602

Acid Dissociation Constant (pKa)

8.65

Base Dissociation Constant (pKb)

-3.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with 1185-1970 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1185-1970?
Check Price and Availability of 1185-1970, 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 1185-1970 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1185-1970
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1185-1970
  • 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 1185-1970 available by request