3215-0912 Screening compound: (2E)-N-(4-iodophenyl)-3-(4-methylphenyl)prop-2-enamide

3215-0912 Screening compound: (2E)-N-(4-iodophenyl)-3-(4-methylphenyl)prop-2-enamide
3215-0912 Screening compound: (2E)-N-(4-iodophenyl)-3-(4-methylphenyl)prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3215-0912
(2E)-N-(4-iodophenyl)-3-(4-methylphenyl)prop-2-enamide

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

3215-0912

Molecular Formula

C16H14INO (C16 H14 INO)

Compound Name

(2E)-N-(4-iodophenyl)-3-(4-methylphenyl)prop-2-enamide

IUPAC name

(2E)-N-(4-iodophenyl)-3-(4-methylphenyl)prop-2-enamide

SMILES

Cc1ccc(/C=C/C(Nc(cc2)ccc2I)=O)cc1

InChI

InChI=1S/C16H14INO/c1-12-2-4-13(5-3-12)6-11-16(19)18-15-9-7-14(17)8-10-15/h2-11H,1H3,(H,18,19)

InChI Key

LBWMHDGVZDBABA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01350175

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.2

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.332

Distribution Coefficient, logD

5.332

Water Solubility, LogSw

-5.45

Polar Surface Area

23.116

Acid Dissociation Constant (pKa)

10.87

Base Dissociation Constant (pKb)

0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

3215-0912 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 3215-0912 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3215-0912?
Check Price and Availability of 3215-0912, 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 3215-0912 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3215-0912
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3215-0912
  • 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 3215-0912 available by request