D579-0115 Screening compound: N-(naphthalen-1-yl)-2-(3-oxo-5-phenyl-2,3-dihydro-1,2,4-triazin-2-yl)propanamide

D579-0115 Screening compound: N-(naphthalen-1-yl)-2-(3-oxo-5-phenyl-2,3-dihydro-1,2,4-triazin-2-yl)propanamide
D579-0115 Screening compound: N-(naphthalen-1-yl)-2-(3-oxo-5-phenyl-2,3-dihydro-1,2,4-triazin-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D579-0115
N-(naphthalen-1-yl)-2-(3-oxo-5-phenyl-2,3-dihydro-1,2,4-triazin-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

D579-0115

Molecular Formula

C22H18N4O2 (C22 H18 N4 O2)

Compound Name

N-(naphthalen-1-yl)-2-(3-oxo-5-phenyl-2,3-dihydro-1,2,4-triazin-2-yl)propanamide

IUPAC name

N-(naphthalen-1-yl)-2-(3-oxo-5-phenyl-23-dihydro-124-triazin-2-yl)propanamide

SMILES

CC(C(Nc1cccc2ccccc12)=O)N1N=CC(c2ccccc2)=NC1=O

InChI

InChI=1S/C22H18N4O2/c1-15(21(27)24-19-13-7-11-16-8-5-6-12-18(16)19)26-22(28)25-20(14-23-26)17-9-3-2-4-10-17/h2-15H,1H3,(H,24,27)/t15-/m0/s1

InChI Key

WJMFPEDLMFPYRK-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD27593713

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.692

Distribution Coefficient, logD

3.689

Water Solubility, LogSw

-3.90

Polar Surface Area

57.988

Acid Dissociation Constant (pKa)

12.12

Base Dissociation Constant (pKb)

5.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

9.10

References: we are preparing a list of scientific research reports with D579-0115 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D579-0115?
Check Price and Availability of D579-0115, 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 D579-0115 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D579-0115
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D579-0115
  • 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 D579-0115 available by request