E020-0491 Screening compound: N-(4-acetamidophenyl)-2-{4-methyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazin-2-yl}acetamide

E020-0491 Screening compound: N-(4-acetamidophenyl)-2-{4-methyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazin-2-yl}acetamide
E020-0491 Screening compound: N-(4-acetamidophenyl)-2-{4-methyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazin-2-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E020-0491
N-(4-acetamidophenyl)-2-{4-methyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazin-2-yl}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

E020-0491

Molecular Formula

C17H17N5O3 (C17 H17 N5 O3)

Compound Name

N-(4-acetamidophenyl)-2-{4-methyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazin-2-yl}acetamide

IUPAC name

N-(4-acetamidophenyl)-2-{4-methyl-1-oxo-1H2H-pyrrolo[12-d][124]triazin-2-yl}acetamide

SMILES

CC(Nc(cc1)ccc1NC(CN(C1=O)N=C(C)n2c1ccc2)=O)=O

InChI

InChI=1S/C17H17N5O3/c1-11-20-22(17(25)15-4-3-9-21(11)15)10-16(24)19-14-7-5-13(6-8-14)18-12(2)23/h3-9H,10H2,1-2H3,(H,18,23)(H,19,24)

InChI Key

NCUXVSJOQJGWEX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14840131

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.333

Distribution Coefficient, logD

1.333

Water Solubility, LogSw

-2.07

Polar Surface Area

76.710

Acid Dissociation Constant (pKa)

12.86

Base Dissociation Constant (pKb)

1.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

References: we are preparing a list of scientific research reports with E020-0491 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E020-0491?
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What is the minimum amount of E020-0491 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E020-0491
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E020-0491
  • 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 E020-0491 available by request