V004-2440 Screening compound: 3-[5-cyclopropyl-3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-1-[4-(trifluoromethyl)phenyl]urea

V004-2440 Screening compound: 3-[5-cyclopropyl-3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-1-[4-(trifluoromethyl)phenyl]urea
V004-2440 Screening compound: 3-[5-cyclopropyl-3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-1-[4-(trifluoromethyl)phenyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-2440
3-[5-cyclopropyl-3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-1-[4-(trifluoromethyl)phenyl]urea

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

V004-2440

Molecular Formula

C21H19F3N4O2 (C21 H19 F3 N4 O2)

Compound Name

3-[5-cyclopropyl-3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-1-[4-(trifluoromethyl)phenyl]urea

IUPAC name

3-[5-cyclopropyl-3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-1-[4-(trifluoromethyl)phenyl]urea

SMILES

COc(cc1)ccc1-c1n[nH]c(C2CC2)c1NC(Nc1ccc(C(F)(F)F)cc1)=O

InChI

InChI=1S/C21H19F3N4O2/c1-30-16-10-4-13(5-11-16)18-19(17(27-28-18)12-2-3-12)26-20(29)25-15-8-6-14(7-9-15)21(22,23)24/h4-12H,2-3H2,1H3,(H,27,28)(H2,25,26,29)

InChI Key

ROJXXPXKKMTMGO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14282236

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

416.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.148

Distribution Coefficient, logD

5.148

Water Solubility, LogSw

-5.05

Polar Surface Area

62.972

Acid Dissociation Constant (pKa)

13.15

Base Dissociation Constant (pKb)

-2.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

V004-2440 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V004-2440 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-2440?
Check Price and Availability of V004-2440, 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 V004-2440 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-2440
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-2440
  • 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 V004-2440 available by request