D584-0435 Screening compound: N-(4-methoxyphenyl)-2-[5-methyl-2-(4-methylphenyl)-7-oxo-4-(prop-2-en-1-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide

D584-0435 Screening compound: N-(4-methoxyphenyl)-2-[5-methyl-2-(4-methylphenyl)-7-oxo-4-(prop-2-en-1-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide
D584-0435 Screening compound: N-(4-methoxyphenyl)-2-[5-methyl-2-(4-methylphenyl)-7-oxo-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 D584-0435
N-(4-methoxyphenyl)-2-[5-methyl-2-(4-methylphenyl)-7-oxo-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

D584-0435

Molecular Formula

C25H25N5O3 (C25 H25 N5 O3)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)ccc1-c(nc1N(CC=C)C(C)=C2CC(Nc(cc3)ccc3OC)=O)nn1C2=O

InChI

InChI=1S/C25H25N5O3/c1-5-14-29-17(3)21(15-22(31)26-19-10-12-20(33-4)13-11-19)24(32)30-25(29)27-23(28-30)18-8-6-16(2)7-9-18/h5-13H,1,14-15H2,2-4H3,(H,26,31)

InChI Key

LMNUKOYGEPSSEE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27594112

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.331

Distribution Coefficient, logD

4.331

Water Solubility, LogSw

-4.34

Polar Surface Area

69.154

Acid Dissociation Constant (pKa)

12.52

Base Dissociation Constant (pKb)

2.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with D584-0435 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D584-0435?
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What is the minimum amount of D584-0435 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D584-0435
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D584-0435
  • 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 D584-0435 available by request