D731-0507 Screening compound: 1-(4-ethoxyphenyl)-5-(methoxymethyl)-N-(2-phenylethyl)-1H-1,2,3-triazole-4-carboxamide

D731-0507 Screening compound: 1-(4-ethoxyphenyl)-5-(methoxymethyl)-N-(2-phenylethyl)-1H-1,2,3-triazole-4-carboxamide
D731-0507 Screening compound: 1-(4-ethoxyphenyl)-5-(methoxymethyl)-N-(2-phenylethyl)-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D731-0507
1-(4-ethoxyphenyl)-5-(methoxymethyl)-N-(2-phenylethyl)-1H-1,2,3-triazole-4-carboxamide

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

D731-0507

Molecular Formula

C21H24N4O3 (C21 H24 N4 O3)

Compound Name

1-(4-ethoxyphenyl)-5-(methoxymethyl)-N-(2-phenylethyl)-1H-1,2,3-triazole-4-carboxamide

IUPAC name

1-(4-ethoxyphenyl)-5-(methoxymethyl)-N-(2-phenylethyl)-1H-123-triazole-4-carboxamide

SMILES

CCOc(cc1)ccc1-n1nnc(C(NCCc2ccccc2)=O)c1COC

InChI

InChI=1S/C21H24N4O3/c1-3-28-18-11-9-17(10-12-18)25-19(15-27-2)20(23-24-25)21(26)22-14-13-16-7-5-4-6-8-16/h4-12H,3,13-15H2,1-2H3,(H,22,26)

InChI Key

NKEGCEPICOMKEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09875305

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.469

Distribution Coefficient, logD

2.469

Water Solubility, LogSw

-2.68

Polar Surface Area

66.394

Acid Dissociation Constant (pKa)

13.07

Base Dissociation Constant (pKb)

-2.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with D731-0507 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D731-0507?
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What is the minimum amount of D731-0507 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D731-0507
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D731-0507
  • 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 D731-0507 available by request