D494-0047 Screening compound: N-[(4-methoxyphenyl)methyl]-5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

D494-0047 Screening compound: N-[(4-methoxyphenyl)methyl]-5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
D494-0047 Screening compound: N-[(4-methoxyphenyl)methyl]-5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D494-0047
N-[(4-methoxyphenyl)methyl]-5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

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

D494-0047

Molecular Formula

C19H18N6O (C19 H18 N6 O)

Compound Name

N-[(4-methoxyphenyl)methyl]-5-methyl-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

IUPAC name

N-[(4-methoxyphenyl)methyl]-5-methyl-2-(pyridin-3-yl)-[124]triazolo[15-a]pyrimidin-7-amine

SMILES

Cc1nc2nc(-c3cnccc3)nn2c(NCc(cc2)ccc2OC)c1

InChI

InChI=1S/C19H18N6O/c1-13-10-17(21-11-14-5-7-16(26-2)8-6-14)25-19(22-13)23-18(24-25)15-4-3-9-20-12-15/h3-10,12,21H,11H2,1-2H3

InChI Key

ARTUIRRSWHDTCJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27589285

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.155

Distribution Coefficient, logD

1.994

Water Solubility, LogSw

-1.97

Polar Surface Area

58.224

Acid Dissociation Constant (pKa)

16.61

Base Dissociation Constant (pKb)

7.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with D494-0047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D494-0047?
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What is the minimum amount of D494-0047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D494-0047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D494-0047
  • 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 D494-0047 available by request