0242-1193 Screening compound: (2E)-3-phenyl-2-[(3,4,5-trimethoxyphenyl)formamido]prop-2-enoic acid

0242-1193 Screening compound: (2E)-3-phenyl-2-[(3,4,5-trimethoxyphenyl)formamido]prop-2-enoic acid
0242-1193 Screening compound: (2E)-3-phenyl-2-[(3,4,5-trimethoxyphenyl)formamido]prop-2-enoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0242-1193
(2E)-3-phenyl-2-[(3,4,5-trimethoxyphenyl)formamido]prop-2-enoic acid

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

0242-1193

Molecular Formula

C19H19NO6 (C19 H19 NO6)

Compound Name

(2E)-3-phenyl-2-[(3,4,5-trimethoxyphenyl)formamido]prop-2-enoic acid

IUPAC name

(2E)-3-phenyl-2-[(345-trimethoxyphenyl)formamido]prop-2-enoic acid

SMILES

COc1cc(C(N/C(/C(O)=O)=C/c2ccccc2)=O)cc(OC)c1OC

InChI

InChI=1S/C19H19NO6/c1-24-15-10-13(11-16(25-2)17(15)26-3)18(21)20-14(19(22)23)9-12-7-5-4-6-8-12/h4-11H,1-3H3,(H,20,21)(H,22,23)

InChI Key

PVKXMGUXMCAGJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00366728

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.36

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.274

Distribution Coefficient, logD

-1.827

Water Solubility, LogSw

-3.04

Polar Surface Area

73.549

Acid Dissociation Constant (pKa)

3.94

Base Dissociation Constant (pKb)

1.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

0242-1193 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 0242-1193 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0242-1193?
Check Price and Availability of 0242-1193, 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 0242-1193 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0242-1193
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0242-1193
  • 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 0242-1193 available by request