D584-0121 Screening compound: N-(2-fluorophenyl)-2-[5-methyl-7-oxo-2-phenyl-4-(prop-2-en-1-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide

D584-0121 Screening compound: N-(2-fluorophenyl)-2-[5-methyl-7-oxo-2-phenyl-4-(prop-2-en-1-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide
D584-0121 Screening compound: N-(2-fluorophenyl)-2-[5-methyl-7-oxo-2-phenyl-4-(prop-2-en-1-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D584-0121
N-(2-fluorophenyl)-2-[5-methyl-7-oxo-2-phenyl-4-(prop-2-en-1-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-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

D584-0121

Molecular Formula

C23H20FN5O2 (C23 H20 FN5 O2)

Compound Name

N-(2-fluorophenyl)-2-[5-methyl-7-oxo-2-phenyl-4-(prop-2-en-1-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide

IUPAC name

N-(2-fluorophenyl)-2-[5-methyl-7-oxo-2-phenyl-4-(prop-2-en-1-yl)-4H7H-[124]triazolo[15-a]pyrimidin-6-yl]acetamide

SMILES

CC(N(CC=C)c1nc(-c2ccccc2)nn11)=C(CC(Nc(cccc2)c2F)=O)C1=O

InChI

InChI=1S/C23H20FN5O2/c1-3-13-28-15(2)17(14-20(30)25-19-12-8-7-11-18(19)24)22(31)29-23(28)26-21(27-29)16-9-5-4-6-10-16/h3-12H,1,13-14H2,2H3,(H,25,30)

InChI Key

WEANAIOLRDCWNK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27593990

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.601

Distribution Coefficient, logD

3.600

Water Solubility, LogSw

-3.66

Polar Surface Area

60.912

Acid Dissociation Constant (pKa)

10.96

Base Dissociation Constant (pKb)

0.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with D584-0121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D584-0121?
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What is the minimum amount of D584-0121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D584-0121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D584-0121
  • 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 D584-0121 available by request