V029-5895 Screening compound: 2-(4-chlorophenoxy)-N-{2-methyl-1-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propyl}acetamide

V029-5895 Screening compound: 2-(4-chlorophenoxy)-N-{2-methyl-1-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propyl}acetamide
V029-5895 Screening compound: 2-(4-chlorophenoxy)-N-{2-methyl-1-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-5895
2-(4-chlorophenoxy)-N-{2-methyl-1-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propyl}acetamide

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

V029-5895

Molecular Formula

C21H22ClN3O3 (C21 H22 ClN3 O3)

Compound Name

2-(4-chlorophenoxy)-N-{2-methyl-1-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propyl}acetamide

IUPAC name

2-(4-chlorophenoxy)-N-{2-methyl-1-[3-(4-methylphenyl)-124-oxadiazol-5-yl]propyl}acetamide

SMILES

CC(C)C(c1nc(-c2ccc(C)cc2)no1)NC(COc(cc1)ccc1Cl)=O

InChI

InChI=1S/C21H22ClN3O3/c1-13(2)19(23-18(26)12-27-17-10-8-16(22)9-11-17)21-24-20(25-28-21)15-6-4-14(3)5-7-15/h4-11,13,19H,12H2,1-3H3,(H,23,26)/t19-/m0/s1

InChI Key

HBLZIJNULPHHMW-IBGZPJMESA-N

MDL Number (MFCD)

MFCD19783759

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

399.88

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.531

Distribution Coefficient, logD

5.531

Water Solubility, LogSw

-5.98

Polar Surface Area

62.967

Acid Dissociation Constant (pKa)

14.02

Base Dissociation Constant (pKb)

-3.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

V029-5895 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V029-5895 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-5895?
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What is the minimum amount of V029-5895 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-5895
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-5895
  • 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 V029-5895 available by request