V028-8817 Screening compound: N-(1-phenylethyl)-4-(trifluoromethyl)-N-{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide

V028-8817 Screening compound: N-(1-phenylethyl)-4-(trifluoromethyl)-N-{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide
V028-8817 Screening compound: N-(1-phenylethyl)-4-(trifluoromethyl)-N-{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-8817
N-(1-phenylethyl)-4-(trifluoromethyl)-N-{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide

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

V028-8817

Molecular Formula

C29H28F3N3O5 (C29 H28 F3 N3 O5)

Compound Name

N-(1-phenylethyl)-4-(trifluoromethyl)-N-{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide

IUPAC name

N-(1-phenylethyl)-4-(trifluoromethyl)-N-{2-[3-(345-trimethoxyphenyl)-124-oxadiazol-5-yl]ethyl}benzamide

SMILES

CC(c1ccccc1)N(CCc1nc(-c(cc2OC)cc(OC)c2OC)no1)C(c1ccc(C(F)(F)F)cc1)=O

InChI

InChI=1S/C29H28F3N3O5/c1-18(19-8-6-5-7-9-19)35(28(36)20-10-12-22(13-11-20)29(30,31)32)15-14-25-33-27(34-40-25)21-16-23(37-2)26(39-4)24(17-21)38-3/h5-13,16-18H,14-15H2,1-4H3/t18-/m0/s1

InChI Key

MPSSBBQUKSFDHM-SFHVURJKSA-N

MDL Number (MFCD)

MFCD19781336

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

555.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.201

Distribution Coefficient, logD

6.201

Water Solubility, LogSw

-5.60

Polar Surface Area

69.841

Acid Dissociation Constant (pKa)

25.02

Base Dissociation Constant (pKb)

-2.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.60

V028-8817 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V028-8817 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-8817?
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What is the minimum amount of V028-8817 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-8817
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-8817
  • 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 V028-8817 available by request