6016-3059 Screening compound: N-(3-METHYLPHENYL)-3-(1-OXO-4-PHENYL-1,2-DIHYDROPHTHALAZIN-2-YL)PROPANAMIDE

6016-3059 Screening compound: N-(3-METHYLPHENYL)-3-(1-OXO-4-PHENYL-1,2-DIHYDROPHTHALAZIN-2-YL)PROPANAMIDE
6016-3059 Screening compound: N-(3-METHYLPHENYL)-3-(1-OXO-4-PHENYL-1,2-DIHYDROPHTHALAZIN-2-YL)PROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 6016-3059
N-(3-METHYLPHENYL)-3-(1-OXO-4-PHENYL-1,2-DIHYDROPHTHALAZIN-2-YL)PROPANAMIDE

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

6016-3059

Molecular Formula

C24H21N3O2 (C24 H21 N3 O2)

Compound Name

N-(3-METHYLPHENYL)-3-(1-OXO-4-PHENYL-1,2-DIHYDROPHTHALAZIN-2-YL)PROPANAMIDE

IUPAC name

N-(3-methylphenyl)-3-(1-oxo-4-phenyl-12-dihydrophthalazin-2-yl)propanamide

SMILES

Cc1cccc(NC(CCN2N=C(c3ccccc3)c(cccc3)c3C2=O)=O)c1

InChI

InChI=1S/C24H21N3O2/c1-17-8-7-11-19(16-17)25-22(28)14-15-27-24(29)21-13-6-5-12-20(21)23(26-27)18-9-3-2-4-10-18/h2-13,16H,14-15H2,1H3,(H,25,28)

InChI Key

JTRIYTMLNBBCAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03691947

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.803

Distribution Coefficient, logD

3.803

Water Solubility, LogSw

-3.93

Polar Surface Area

50.323

Acid Dissociation Constant (pKa)

12.63

Base Dissociation Constant (pKb)

3.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

6016-3059 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 6016-3059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6016-3059?
Check Price and Availability of 6016-3059, 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 6016-3059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6016-3059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6016-3059
  • 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 6016-3059 available by request