V015-7157 Screening compound: ethyl (5E)-5-[(2-hydroxy-4-methoxyphenyl)methylidene]-4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4,5-dihydrothiophene-3-carboxylate

V015-7157 Screening compound: ethyl (5E)-5-[(2-hydroxy-4-methoxyphenyl)methylidene]-4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4,5-dihydrothiophene-3-carboxylate
V015-7157 Screening compound: ethyl (5E)-5-[(2-hydroxy-4-methoxyphenyl)methylidene]-4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4,5-dihydrothiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-7157
ethyl (5E)-5-[(2-hydroxy-4-methoxyphenyl)methylidene]-4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4,5-dihydrothiophene-3-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

V015-7157

Molecular Formula

C22H18F3NO5S (C22 H18 F3 NO5 S)

Compound Name

ethyl (5E)-5-[(2-hydroxy-4-methoxyphenyl)methylidene]-4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4,5-dihydrothiophene-3-carboxylate

IUPAC name

ethyl (5E)-5-[(2-hydroxy-4-methoxyphenyl)methylidene]-4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-45-dihydrothiophene-3-carboxylate

SMILES

CCOC(C(C1=O)=C(Nc2cc(C(F)(F)F)ccc2)S/C1=C/c(ccc(OC)c1)c1O)=O

InChI

InChI=1S/C22H18F3NO5S/c1-3-31-21(29)18-19(28)17(9-12-7-8-15(30-2)11-16(12)27)32-20(18)26-14-6-4-5-13(10-14)22(23,24)25/h4-11,26-27H,3H2,1-2H3

InChI Key

VHFQISGPWJNENK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19880569

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

465.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.934

Distribution Coefficient, logD

5.038

Water Solubility, LogSw

-5.39

Polar Surface Area

66.209

Acid Dissociation Constant (pKa)

6.56

Base Dissociation Constant (pKb)

-1.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

V015-7157 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V015-7157 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-7157?
Check Price and Availability of V015-7157, 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 V015-7157 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-7157
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-7157
  • 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 V015-7157 available by request