V005-2986 Screening compound: 3-phenyl-N-{2-phenyl-1-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}propanamide

V005-2986 Screening compound: 3-phenyl-N-{2-phenyl-1-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}propanamide
V005-2986 Screening compound: 3-phenyl-N-{2-phenyl-1-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-2986
3-phenyl-N-{2-phenyl-1-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}propanamide

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

V005-2986

Molecular Formula

C28H29N3O5 (C28 H29 N3 O5)

Compound Name

3-phenyl-N-{2-phenyl-1-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}propanamide

IUPAC name

3-phenyl-N-{2-phenyl-1-[3-(345-trimethoxyphenyl)-124-oxadiazol-5-yl]ethyl}propanamide

SMILES

COc1cc(-c2noc(C(Cc3ccccc3)NC(CCc3ccccc3)=O)n2)cc(OC)c1OC

InChI

InChI=1S/C28H29N3O5/c1-33-23-17-21(18-24(34-2)26(23)35-3)27-30-28(36-31-27)22(16-20-12-8-5-9-13-20)29-25(32)15-14-19-10-6-4-7-11-19/h4-13,17-18,22H,14-16H2,1-3H3,(H,29,32)/t22-/m0/s1

InChI Key

IWCJUOLGBZSDRH-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19781330

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.182

Distribution Coefficient, logD

5.182

Water Solubility, LogSw

-5.13

Polar Surface Area

78.452

Acid Dissociation Constant (pKa)

11.93

Base Dissociation Constant (pKb)

-2.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

V005-2986 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V005-2986 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-2986?
Check Price and Availability of V005-2986, 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 V005-2986 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-2986
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-2986
  • 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 V005-2986 available by request