P032-1926 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl]acetamide

P032-1926 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl]acetamide
P032-1926 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P032-1926
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-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

P032-1926

Molecular Formula

C23H21N5O5 (C23 H21 N5 O5)

Compound Name

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-2-yl]acetamide

IUPAC name

N-(23-dihydro-14-benzodioxin-6-yl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl-2H3H-[124]triazolo[43-c]pyrimidin-2-yl]acetamide

SMILES

COCC(N=C(c1ccccc1)N12)=CC2=NN(CC(Nc(cc2)cc3c2OCCO3)=O)C1=O

InChI

InChI=1S/C23H21N5O5/c1-31-14-17-12-20-26-27(23(30)28(20)22(25-17)15-5-3-2-4-6-15)13-21(29)24-16-7-8-18-19(11-16)33-10-9-32-18/h2-8,11-12H,9-10,13-14H2,1H3,(H,24,29)

InChI Key

UKFPDLQZVCDHOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27559269

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.621

Distribution Coefficient, logD

1.600

Water Solubility, LogSw

-2.35

Polar Surface Area

89.727

Acid Dissociation Constant (pKa)

12.03

Base Dissociation Constant (pKb)

6.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with P032-1926 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P032-1926?
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What is the minimum amount of P032-1926 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P032-1926
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P032-1926
  • 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 P032-1926 available by request