8010-5449 Screening compound: 2-formyl-6-methoxyphenyl morpholine-4-carboxylate

8010-5449 Screening compound: 2-formyl-6-methoxyphenyl morpholine-4-carboxylate
8010-5449 Screening compound: 2-formyl-6-methoxyphenyl morpholine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-5449
2-formyl-6-methoxyphenyl morpholine-4-carboxylate

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

8010-5449

Molecular Formula

C13H15NO5 (C13 H15 NO5)

Compound Name

2-formyl-6-methoxyphenyl morpholine-4-carboxylate

IUPAC name

2-formyl-6-methoxyphenyl morpholine-4-carboxylate

SMILES

COc(cccc1C=O)c1OC(N1CCOCC1)=O

InChI

InChI=1S/C13H15NO5/c1-17-11-4-2-3-10(9-15)12(11)19-13(16)14-5-7-18-8-6-14/h2-4,9H,5-8H2,1H3

InChI Key

SKAPDLHPMQQAGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02646678

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

265.27

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.270

Distribution Coefficient, logD

1.270

Water Solubility, LogSw

-1.69

Polar Surface Area

52.706

Acid Dissociation Constant (pKa)

29.10

Base Dissociation Constant (pKb)

-2.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

8010-5449 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 8010-5449 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-5449?
Check Price and Availability of 8010-5449, 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 8010-5449 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-5449
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-5449
  • 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 8010-5449 available by request