V002-2886 Screening compound: 5-(2,5-dimethylphenyl)-N-isobutyl-N-(3-oxo-3-{[2-(2-pyridyl)ethyl]amino}propyl)-3-isoxazolecarboxamide

V002-2886 Screening compound: 5-(2,5-dimethylphenyl)-N-isobutyl-N-(3-oxo-3-{[2-(2-pyridyl)ethyl]amino}propyl)-3-isoxazolecarboxamide
V002-2886 Screening compound: 5-(2,5-dimethylphenyl)-N-isobutyl-N-(3-oxo-3-{[2-(2-pyridyl)ethyl]amino}propyl)-3-isoxazolecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-2886
5-(2,5-dimethylphenyl)-N-isobutyl-N-(3-oxo-3-{[2-(2-pyridyl)ethyl]amino}propyl)-3-isoxazolecarboxamide

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

V002-2886

Molecular Formula

C26H32N4O3 (C26 H32 N4 O3)

Compound Name

5-(2,5-dimethylphenyl)-N-isobutyl-N-(3-oxo-3-{[2-(2-pyridyl)ethyl]amino}propyl)-3-isoxazolecarboxamide

IUPAC name

3-{1-[5-(25-dimethylphenyl)-12-oxazol-3-yl]-N-(2-methylpropyl)formamido}-N-[2-(pyridin-2-yl)ethyl]propanamide

SMILES

CC(C)CN(CCC(NCCc1ncccc1)=O)C(c1noc(-c2c(C)ccc(C)c2)c1)=O

InChI

InChI=1S/C26H32N4O3/c1-18(2)17-30(14-11-25(31)28-13-10-21-7-5-6-12-27-21)26(32)23-16-24(33-29-23)22-15-19(3)8-9-20(22)4/h5-9,12,15-16,18H,10-11,13-14,17H2,1-4H3,(H,28,31)

InChI Key

GKKYPEXAZWQAHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19823294

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

448.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.847

Distribution Coefficient, logD

3.842

Water Solubility, LogSw

-3.76

Polar Surface Area

71.819

Acid Dissociation Constant (pKa)

14.45

Base Dissociation Constant (pKb)

5.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.46

References: we are preparing a list of scientific research reports with V002-2886 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-2886?
Check Price and Availability of V002-2886, 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 V002-2886 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-2886
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-2886
  • 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 V002-2886 available by request