V003-0002 Screening compound: 5-(2,4-dichlorophenyl)-N~3~-(2-methoxyethyl)-N~3~-(3-oxo-3-{[2-(2-pyridyl)ethyl]amino}propyl)-3-isoxazolecarboxamide

V003-0002 Screening compound: 5-(2,4-dichlorophenyl)-N~3~-(2-methoxyethyl)-N~3~-(3-oxo-3-{[2-(2-pyridyl)ethyl]amino}propyl)-3-isoxazolecarboxamide
V003-0002 Screening compound: 5-(2,4-dichlorophenyl)-N~3~-(2-methoxyethyl)-N~3~-(3-oxo-3-{[2-(2-pyridyl)ethyl]amino}propyl)-3-isoxazolecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-0002
5-(2,4-dichlorophenyl)-N~3~-(2-methoxyethyl)-N~3~-(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

V003-0002

Molecular Formula

C23H24Cl2N4O4 (C23 H24 Cl2 N4 O4)

Compound Name

5-(2,4-dichlorophenyl)-N~3~-(2-methoxyethyl)-N~3~-(3-oxo-3-{[2-(2-pyridyl)ethyl]amino}propyl)-3-isoxazolecarboxamide

IUPAC name

n/a

SMILES

COCCN(CCC(NCCc1ncccc1)=O)C(c1noc(-c(ccc(Cl)c2)c2Cl)c1)=O

InChI

InChI=1S/C23H24Cl2N4O4/c1-32-13-12-29(11-8-22(30)27-10-7-17-4-2-3-9-26-17)23(31)20-15-21(33-28-20)18-6-5-16(24)14-19(18)25/h2-6,9,14-15H,7-8,10-13H2,1H3,(H,27,30)

InChI Key

LKFTWEZKDXOONI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19812888

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.37

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.820

Distribution Coefficient, logD

2.815

Water Solubility, LogSw

-3.65

Polar Surface Area

80.140

Acid Dissociation Constant (pKa)

14.45

Base Dissociation Constant (pKb)

5.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with V003-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-0002?
Check Price and Availability of V003-0002, 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 V003-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-0002
  • 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 V003-0002 available by request