V031-2668 Screening compound: N-(4-{4H,5H-naphtho[1,2-c][1,2]oxazol-3-yl}phenyl)-2-phenylbutanamide

V031-2668 Screening compound: N-(4-{4H,5H-naphtho[1,2-c][1,2]oxazol-3-yl}phenyl)-2-phenylbutanamide
V031-2668 Screening compound: N-(4-{4H,5H-naphtho[1,2-c][1,2]oxazol-3-yl}phenyl)-2-phenylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-2668
N-(4-{4H,5H-naphtho[1,2-c][1,2]oxazol-3-yl}phenyl)-2-phenylbutanamide

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

V031-2668

Molecular Formula

C27H24N2O2 (C27 H24 N2 O2)

Compound Name

N-(4-{4H,5H-naphtho[1,2-c][1,2]oxazol-3-yl}phenyl)-2-phenylbutanamide

IUPAC name

N-(4-{4H5H-naphtho[12-c][12]oxazol-3-yl}phenyl)-2-phenylbutanamide

SMILES

CCC(C(Nc(cc1)ccc1-c1c(CCc2c-3cccc2)c3no1)=O)c1ccccc1

InChI

InChI=1S/C27H24N2O2/c1-2-22(18-8-4-3-5-9-18)27(30)28-21-15-12-20(13-16-21)26-24-17-14-19-10-6-7-11-23(19)25(24)29-31-26/h3-13,15-16,22H,2,14,17H2,1H3,(H,28,30)/t22-/m1/s1

InChI Key

YPXNAUPCKHRFJX-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD19963742

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

408.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.425

Distribution Coefficient, logD

6.425

Water Solubility, LogSw

-5.76

Polar Surface Area

45.608

Acid Dissociation Constant (pKa)

11.99

Base Dissociation Constant (pKb)

1.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.50

V031-2668 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V031-2668 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-2668?
Check Price and Availability of V031-2668, 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 V031-2668 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-2668
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-2668
  • 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 V031-2668 available by request