D731-0059 Screening compound: N-[(furan-2-yl)methyl]-1-(4-methoxyphenyl)-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide

D731-0059 Screening compound: N-[(furan-2-yl)methyl]-1-(4-methoxyphenyl)-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
D731-0059 Screening compound: N-[(furan-2-yl)methyl]-1-(4-methoxyphenyl)-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D731-0059
N-[(furan-2-yl)methyl]-1-(4-methoxyphenyl)-5-(propan-2-yl)-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

D731-0059

Molecular Formula

C18H20N4O3 (C18 H20 N4 O3)

Compound Name

N-[(furan-2-yl)methyl]-1-(4-methoxyphenyl)-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide

IUPAC name

N-[(furan-2-yl)methyl]-1-(4-methoxyphenyl)-5-(propan-2-yl)-1H-123-triazole-4-carboxamide

SMILES

CC(C)c1c(C(NCc2ccco2)=O)nnn1-c(cc1)ccc1OC

InChI

InChI=1S/C18H20N4O3/c1-12(2)17-16(18(23)19-11-15-5-4-10-25-15)20-21-22(17)13-6-8-14(24-3)9-7-13/h4-10,12H,11H2,1-3H3,(H,19,23)

InChI Key

CFIARYAIUDOHCW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11842754

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.38

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

3.535

Distribution Coefficient, logD

3.535

Water Solubility, LogSw

-3.63

Polar Surface Area

65.817

Acid Dissociation Constant (pKa)

11.56

Base Dissociation Constant (pKb)

-1.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

References: we are preparing a list of scientific research reports with D731-0059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D731-0059?
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What is the minimum amount of D731-0059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D731-0059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D731-0059
  • 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 D731-0059 available by request