V026-2978 Screening compound: 1-{[3-(4-fluorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-3-(2-methoxyphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}urea

V026-2978 Screening compound: 1-{[3-(4-fluorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-3-(2-methoxyphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}urea
V026-2978 Screening compound: 1-{[3-(4-fluorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-3-(2-methoxyphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-2978
1-{[3-(4-fluorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-3-(2-methoxyphenyl)-1-{[3-(trifluoromethyl)phenyl]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

V026-2978

Molecular Formula

C26H23F4N3O3 (C26 H23 F4 N3 O3)

Compound Name

1-{[3-(4-fluorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-3-(2-methoxyphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}urea

IUPAC name

1-{[3-(4-fluorophenyl)-45-dihydro-12-oxazol-5-yl]methyl}-3-(2-methoxyphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}urea

SMILES

COc(cccc1)c1NC(N(CC(C1)ON=C1c(cc1)ccc1F)Cc1cc(C(F)(F)F)ccc1)=O

InChI

InChI=1S/C26H23F4N3O3/c1-35-24-8-3-2-7-22(24)31-25(34)33(15-17-5-4-6-19(13-17)26(28,29)30)16-21-14-23(32-36-21)18-9-11-20(27)12-10-18/h2-13,21H,14-16H2,1H3,(H,31,34)/t21-/m0/s1

InChI Key

CSLZMCPGRMCAGH-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19797668

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

501.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.804

Distribution Coefficient, logD

5.804

Water Solubility, LogSw

-5.71

Polar Surface Area

54.767

Acid Dissociation Constant (pKa)

12.82

Base Dissociation Constant (pKb)

-2.50

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.10

V026-2978 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with V026-2978 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-2978?
Check Price and Availability of V026-2978, 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 V026-2978 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-2978
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-2978
  • 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 V026-2978 available by request