4449-2017 Screening compound: ETHYL 2-[(5E)-5-{[5-(MORPHOLIN-4-YL)FURAN-2-YL]METHYLIDENE}-2,4-DIOXO-1,3-THIAZOLIDIN-3-YL]ACETATE

4449-2017 Screening compound: ETHYL 2-[(5E)-5-{[5-(MORPHOLIN-4-YL)FURAN-2-YL]METHYLIDENE}-2,4-DIOXO-1,3-THIAZOLIDIN-3-YL]ACETATE
4449-2017 Screening compound: ETHYL 2-[(5E)-5-{[5-(MORPHOLIN-4-YL)FURAN-2-YL]METHYLIDENE}-2,4-DIOXO-1,3-THIAZOLIDIN-3-YL]ACETATE alternative view

Chemical Structure Depiction of ChemDiv screening compound 4449-2017
ETHYL 2-[(5E)-5-{[5-(MORPHOLIN-4-YL)FURAN-2-YL]METHYLIDENE}-2,4-DIOXO-1,3-THIAZOLIDIN-3-YL]ACETATE

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

4449-2017

Molecular Formula

C16H18N2O6S (C16 H18 N2 O6 S)

Compound Name

ETHYL 2-[(5E)-5-{[5-(MORPHOLIN-4-YL)FURAN-2-YL]METHYLIDENE}-2,4-DIOXO-1,3-THIAZOLIDIN-3-YL]ACETATE

IUPAC name

n/a

SMILES

CCOC(CN(C(/C(/S1)=C\c2ccc(N3CCOCC3)o2)=O)C1=O)=O

InChI

InChI=1S/C16H18N2O6S/c1-2-23-14(19)10-18-15(20)12(25-16(18)21)9-11-3-4-13(24-11)17-5-7-22-8-6-17/h3-4,9H,2,5-8,10H2,1H3

InChI Key

DRBATOSLNKOIGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03141532

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.39

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.993

Distribution Coefficient, logD

1.993

Water Solubility, LogSw

-2.33

Polar Surface Area

69.836

Acid Dissociation Constant (pKa)

22.31

Base Dissociation Constant (pKb)

-3.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

4449-2017 in Drug Discovery

Included in Screening Libraries

Integrin Receptors Targeted library (1715 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 4449-2017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4449-2017?
Check Price and Availability of 4449-2017, 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 4449-2017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4449-2017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4449-2017
  • 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 4449-2017 available by request