V030-4049 Screening compound: N-butyl-N-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-fluorobenzamide

V030-4049 Screening compound: N-butyl-N-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-fluorobenzamide
V030-4049 Screening compound: N-butyl-N-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-4049
N-butyl-N-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-fluorobenzamide

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

V030-4049

Molecular Formula

C21H21ClFN3O2 (C21 H21 ClFN3 O2)

Compound Name

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

IUPAC name

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

SMILES

CCCCN(CCc1nc(-c(cc2)ccc2Cl)no1)C(c1cc(F)ccc1)=O

InChI

InChI=1S/C21H21ClFN3O2/c1-2-3-12-26(21(27)16-5-4-6-18(23)14-16)13-11-19-24-20(25-28-19)15-7-9-17(22)10-8-15/h4-10,14H,2-3,11-13H2,1H3

InChI Key

QIBRRMXTVQOILH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20493642

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

401.87

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.373

Distribution Coefficient, logD

5.373

Water Solubility, LogSw

-5.97

Polar Surface Area

47.749

Acid Dissociation Constant (pKa)

28.16

Base Dissociation Constant (pKb)

-1.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with V030-4049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-4049?
Check Price and Availability of V030-4049, 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 V030-4049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-4049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-4049
  • 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 V030-4049 available by request