2548-0215 Screening compound: (2,6-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino (2Z)-3-phenylprop-2-enoate

2548-0215 Screening compound: (2,6-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino (2Z)-3-phenylprop-2-enoate
2548-0215 Screening compound: (2,6-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino (2Z)-3-phenylprop-2-enoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2548-0215
(2,6-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino (2Z)-3-phenylprop-2-enoate

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

2548-0215

Molecular Formula

C17H15NO3 (C17 H15 NO3)

Compound Name

(2,6-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino (2Z)-3-phenylprop-2-enoate

IUPAC name

(26-dimethyl-4-oxocyclohexa-25-dien-1-ylidene)amino (2Z)-3-phenylprop-2-enoate

SMILES

CC(C(C(C)=C1)=NOC(/C=C\c2ccccc2)=O)=CC1=O

InChI

InChI=1S/C17H15NO3/c1-12-10-15(19)11-13(2)17(12)18-21-16(20)9-8-14-6-4-3-5-7-14/h3-11H,1-2H3

InChI Key

KDCGPKQNBSVSIL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02084638

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

281.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.145

Distribution Coefficient, logD

3.145

Water Solubility, LogSw

-3.17

Polar Surface Area

43.773

Acid Dissociation Constant (pKa)

35.36

Base Dissociation Constant (pKb)

2.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

2548-0215 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Human Kinases Annotated Library (2415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 2548-0215 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2548-0215?
Check Price and Availability of 2548-0215, 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 2548-0215 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2548-0215
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2548-0215
  • 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 2548-0215 available by request