E016-2690 Screening compound: 2-[2-(4-ethylphenyl)-7-methyl-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(3-phenylpropyl)acetamide

E016-2690 Screening compound: 2-[2-(4-ethylphenyl)-7-methyl-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(3-phenylpropyl)acetamide
E016-2690 Screening compound: 2-[2-(4-ethylphenyl)-7-methyl-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(3-phenylpropyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E016-2690
2-[2-(4-ethylphenyl)-7-methyl-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(3-phenylpropyl)acetamide

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

E016-2690

Molecular Formula

C25H27N5O2 (C25 H27 N5 O2)

Compound Name

2-[2-(4-ethylphenyl)-7-methyl-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(3-phenylpropyl)acetamide

IUPAC name

2-[2-(4-ethylphenyl)-7-methyl-4-oxo-4H5H-pyrazolo[15-d][124]triazin-5-yl]-N-(3-phenylpropyl)acetamide

SMILES

CCc(cc1)ccc1-c(cc12)nn1C(C)=NN(CC(NCCCc1ccccc1)=O)C2=O

InChI

InChI=1S/C25H27N5O2/c1-3-19-11-13-21(14-12-19)22-16-23-25(32)29(27-18(2)30(23)28-22)17-24(31)26-15-7-10-20-8-5-4-6-9-20/h4-6,8-9,11-14,16H,3,7,10,15,17H2,1-2H3,(H,26,31)

InChI Key

LGZHJOZSEIKGME-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14838802

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.531

Distribution Coefficient, logD

4.531

Water Solubility, LogSw

-4.28

Polar Surface Area

65.079

Acid Dissociation Constant (pKa)

15.23

Base Dissociation Constant (pKb)

0.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

References: we are preparing a list of scientific research reports with E016-2690 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E016-2690?
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What is the minimum amount of E016-2690 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E016-2690
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E016-2690
  • 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 E016-2690 available by request