V030-5487 Screening compound: N-(butan-2-yl)-N-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzamide

V030-5487 Screening compound: N-(butan-2-yl)-N-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzamide
V030-5487 Screening compound: N-(butan-2-yl)-N-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-5487
N-(butan-2-yl)-N-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzamide

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

V030-5487

Molecular Formula

C22H24ClN3O2 (C22 H24 ClN3 O2)

Compound Name

N-(butan-2-yl)-N-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzamide

IUPAC name

N-(butan-2-yl)-N-{2-[3-(4-chlorophenyl)-124-oxadiazol-5-yl]ethyl}-4-methylbenzamide

SMILES

CCC(C)N(CCc1nc(-c(cc2)ccc2Cl)no1)C(c1ccc(C)cc1)=O

InChI

InChI=1S/C22H24ClN3O2/c1-4-16(3)26(22(27)18-7-5-15(2)6-8-18)14-13-20-24-21(25-28-20)17-9-11-19(23)12-10-17/h5-12,16H,4,13-14H2,1-3H3/t16-/m0/s1

InChI Key

LUKRCRAOZYSYSQ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD19781713

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

397.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.132

Distribution Coefficient, logD

6.132

Water Solubility, LogSw

-6.24

Polar Surface Area

47.099

Acid Dissociation Constant (pKa)

26.89

Base Dissociation Constant (pKb)

-1.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

References: we are preparing a list of scientific research reports with V030-5487 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-5487?
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What is the minimum amount of V030-5487 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-5487
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-5487
  • 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 V030-5487 available by request