V025-3497 Screening compound: 3-[5-amino-3-(4-chlorophenyl)-1-(2,5-difluorophenyl)-1H-pyrazol-4-yl]-1-[(4-fluorophenyl)methyl]urea

V025-3497 Screening compound: 3-[5-amino-3-(4-chlorophenyl)-1-(2,5-difluorophenyl)-1H-pyrazol-4-yl]-1-[(4-fluorophenyl)methyl]urea
V025-3497 Screening compound: 3-[5-amino-3-(4-chlorophenyl)-1-(2,5-difluorophenyl)-1H-pyrazol-4-yl]-1-[(4-fluorophenyl)methyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-3497
3-[5-amino-3-(4-chlorophenyl)-1-(2,5-difluorophenyl)-1H-pyrazol-4-yl]-1-[(4-fluorophenyl)methyl]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

V025-3497

Molecular Formula

C23H17ClF3N5O (C23 H17 ClF3 N5 O)

Compound Name

3-[5-amino-3-(4-chlorophenyl)-1-(2,5-difluorophenyl)-1H-pyrazol-4-yl]-1-[(4-fluorophenyl)methyl]urea

IUPAC name

3-[5-amino-3-(4-chlorophenyl)-1-(25-difluorophenyl)-1H-pyrazol-4-yl]-1-[(4-fluorophenyl)methyl]urea

SMILES

Nc(n(-c(cc(cc1)F)c1F)nc1-c(cc2)ccc2Cl)c1NC(NCc(cc1)ccc1F)=O

InChI

InChI=1S/C23H17ClF3N5O/c24-15-5-3-14(4-6-15)20-21(30-23(33)29-12-13-1-7-16(25)8-2-13)22(28)32(31-20)19-11-17(26)9-10-18(19)27/h1-11H,12,28H2,(H2,29,30,33)

InChI Key

MUEBCWLMPQZMOT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14265576

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

471.87

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.221

Distribution Coefficient, logD

4.221

Water Solubility, LogSw

-4.62

Polar Surface Area

65.758

Acid Dissociation Constant (pKa)

12.22

Base Dissociation Constant (pKb)

-3.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

V025-3497 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V025-3497 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-3497?
Check Price and Availability of V025-3497, 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 V025-3497 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-3497
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-3497
  • 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 V025-3497 available by request