V005-5687 Screening compound: benzyl[2-hydroxy-3-(prop-2-en-1-yloxy)propyl]{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}amine

V005-5687 Screening compound: benzyl[2-hydroxy-3-(prop-2-en-1-yloxy)propyl]{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}amine
V005-5687 Screening compound: benzyl[2-hydroxy-3-(prop-2-en-1-yloxy)propyl]{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-5687
benzyl[2-hydroxy-3-(prop-2-en-1-yloxy)propyl]{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}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

V005-5687

Molecular Formula

C26H33N3O6 (C26 H33 N3 O6)

Compound Name

benzyl[2-hydroxy-3-(prop-2-en-1-yloxy)propyl]{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}amine

IUPAC name

benzyl[2-hydroxy-3-(prop-2-en-1-yloxy)propyl]{2-[3-(345-trimethoxyphenyl)-124-oxadiazol-5-yl]ethyl}amine

SMILES

COc1cc(-c2noc(CCN(CC(COCC=C)O)Cc3ccccc3)n2)cc(OC)c1OC

InChI

InChI=1S/C26H33N3O6/c1-5-13-34-18-21(30)17-29(16-19-9-7-6-8-10-19)12-11-24-27-26(28-35-24)20-14-22(31-2)25(33-4)23(15-20)32-3/h5-10,14-15,21,30H,1,11-13,16-18H2,2-4H3/t21-/m0/s1

InChI Key

UQYDBEDKRSQDLT-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19870572

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

483.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.505

Distribution Coefficient, logD

3.389

Water Solubility, LogSw

-3.58

Polar Surface Area

83.222

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

6.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with V005-5687 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-5687?
Check Price and Availability of V005-5687, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V005-5687 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-5687
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-5687
  • 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 V005-5687 available by request