V002-6540 Screening compound: (5Z)-3-[(3,4-difluorophenyl)methyl]-5-({3-[(4-fluorophenyl)methyl]-5-hydroxy-1-(4-methoxyphenyl)-1H-pyrazol-4-yl}methylidene)imidazolidine-2,4-dione

V002-6540 Screening compound: (5Z)-3-[(3,4-difluorophenyl)methyl]-5-({3-[(4-fluorophenyl)methyl]-5-hydroxy-1-(4-methoxyphenyl)-1H-pyrazol-4-yl}methylidene)imidazolidine-2,4-dione
V002-6540 Screening compound: (5Z)-3-[(3,4-difluorophenyl)methyl]-5-({3-[(4-fluorophenyl)methyl]-5-hydroxy-1-(4-methoxyphenyl)-1H-pyrazol-4-yl}methylidene)imidazolidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-6540
(5Z)-3-[(3,4-difluorophenyl)methyl]-5-({3-[(4-fluorophenyl)methyl]-5-hydroxy-1-(4-methoxyphenyl)-1H-pyrazol-4-yl}methylidene)imidazolidine-2,4-dione

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

V002-6540

Molecular Formula

C28H21F3N4O4 (C28 H21 F3 N4 O4)

Compound Name

(5Z)-3-[(3,4-difluorophenyl)methyl]-5-({3-[(4-fluorophenyl)methyl]-5-hydroxy-1-(4-methoxyphenyl)-1H-pyrazol-4-yl}methylidene)imidazolidine-2,4-dione

IUPAC name

(5Z)-3-[(34-difluorophenyl)methyl]-5-({3-[(4-fluorophenyl)methyl]-5-hydroxy-1-(4-methoxyphenyl)-1H-pyrazol-4-yl}methylidene)imidazolidine-24-dione

SMILES

COc(cc1)ccc1-n1nc(Cc(cc2)ccc2F)c(/C=C(/C(N2Cc(cc3)cc(F)c3F)=O)\NC2=O)c1O

InChI

InChI=1S/C28H21F3N4O4/c1-39-20-9-7-19(8-10-20)35-26(36)21(24(33-35)13-16-2-5-18(29)6-3-16)14-25-27(37)34(28(38)32-25)15-17-4-11-22(30)23(31)12-17/h2-12,14,36H,13,15H2,1H3,(H,32,38)

InChI Key

VFSWOCUDRMRGHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19770669

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

534.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.586

Distribution Coefficient, logD

3.268

Water Solubility, LogSw

-4.33

Polar Surface Area

78.481

Acid Dissociation Constant (pKa)

6.10

Base Dissociation Constant (pKb)

0.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.70

References: we are preparing a list of scientific research reports with V002-6540 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-6540?
Check Price and Availability of V002-6540, 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 V002-6540 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-6540
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-6540
  • 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 V002-6540 available by request