V012-9942 Screening compound: 5-CHLORO-3-[1-(2,5-DIFLUOROBENZOYL)PIPERIDIN-4-YL]-2,3-DIHYDRO-1,3-BENZOXAZOL-2-ONE

V012-9942 Screening compound: 5-CHLORO-3-[1-(2,5-DIFLUOROBENZOYL)PIPERIDIN-4-YL]-2,3-DIHYDRO-1,3-BENZOXAZOL-2-ONE
V012-9942 Screening compound: 5-CHLORO-3-[1-(2,5-DIFLUOROBENZOYL)PIPERIDIN-4-YL]-2,3-DIHYDRO-1,3-BENZOXAZOL-2-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-9942
5-CHLORO-3-[1-(2,5-DIFLUOROBENZOYL)PIPERIDIN-4-YL]-2,3-DIHYDRO-1,3-BENZOXAZOL-2-ONE

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

V012-9942

Molecular Formula

C19H15ClF2N2O3 (C19 H15 ClF2 N2 O3)

Compound Name

5-CHLORO-3-[1-(2,5-DIFLUOROBENZOYL)PIPERIDIN-4-YL]-2,3-DIHYDRO-1,3-BENZOXAZOL-2-ONE

IUPAC name

5-chloro-3-[1-(25-difluorobenzoyl)piperidin-4-yl]-23-dihydro-13-benzoxazol-2-one

SMILES

O=C(c(cc(cc1)F)c1F)N(CC1)CCC1N(c(cc(cc1)Cl)c1O1)C1=O

InChI

InChI=1S/C19H15ClF2N2O3/c20-11-1-4-17-16(9-11)24(19(26)27-17)13-5-7-23(8-6-13)18(25)14-10-12(21)2-3-15(14)22/h1-4,9-10,13H,5-8H2

InChI Key

ZRYYOEYFDQDDQM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19980060

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.79

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.899

Distribution Coefficient, logD

3.899

Water Solubility, LogSw

-4.44

Polar Surface Area

38.745

Acid Dissociation Constant (pKa)

26.03

Base Dissociation Constant (pKb)

-1.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

V012-9942 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V012-9942 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-9942?
Check Price and Availability of V012-9942, 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 V012-9942 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-9942
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-9942
  • 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 V012-9942 available by request