V005-9183 Screening compound: N-{[3-(4-fluorophenyl)-5-(4-methylpiperazino)-4-isoxazolyl]methyl}-N'-(4-methylphenyl)-N-propylurea

V005-9183 Screening compound: N-{[3-(4-fluorophenyl)-5-(4-methylpiperazino)-4-isoxazolyl]methyl}-N'-(4-methylphenyl)-N-propylurea
V005-9183 Screening compound: N-{[3-(4-fluorophenyl)-5-(4-methylpiperazino)-4-isoxazolyl]methyl}-N'-(4-methylphenyl)-N-propylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-9183
N-{[3-(4-fluorophenyl)-5-(4-methylpiperazino)-4-isoxazolyl]methyl}-N'-(4-methylphenyl)-N-propylurea

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

V005-9183

Molecular Formula

C26H32FN5O2 (C26 H32 FN5 O2)

Compound Name

N-{[3-(4-fluorophenyl)-5-(4-methylpiperazino)-4-isoxazolyl]methyl}-N'-(4-methylphenyl)-N-propylurea

IUPAC name

n/a

SMILES

CCCN(Cc1c(N2CCN(C)CC2)onc1-c(cc1)ccc1F)C(Nc1ccc(C)cc1)=O

InChI

InChI=1S/C26H32FN5O2/c1-4-13-32(26(33)28-22-11-5-19(2)6-12-22)18-23-24(20-7-9-21(27)10-8-20)29-34-25(23)31-16-14-30(3)15-17-31/h5-12H,4,13-18H2,1-3H3,(H,28,33)

InChI Key

HCGCRQRHKNKBOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19883459

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.606

Distribution Coefficient, logD

3.227

Water Solubility, LogSw

-4.25

Polar Surface Area

55.023

Acid Dissociation Constant (pKa)

14.01

Base Dissociation Constant (pKb)

8.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

V005-9183 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V005-9183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-9183?
Check Price and Availability of V005-9183, 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 V005-9183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-9183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-9183
  • 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 V005-9183 available by request