V018-7444 Screening compound: 2-({[(3-fluorophenyl)methyl]({[3-(trifluoromethyl)phenyl]methyl})amino}methyl)-N-[(pyridin-3-yl)methyl]-1,3-oxazole-4-carboxamide

V018-7444 Screening compound: 2-({[(3-fluorophenyl)methyl]({[3-(trifluoromethyl)phenyl]methyl})amino}methyl)-N-[(pyridin-3-yl)methyl]-1,3-oxazole-4-carboxamide
V018-7444 Screening compound: 2-({[(3-fluorophenyl)methyl]({[3-(trifluoromethyl)phenyl]methyl})amino}methyl)-N-[(pyridin-3-yl)methyl]-1,3-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-7444
2-({[(3-fluorophenyl)methyl]({[3-(trifluoromethyl)phenyl]methyl})amino}methyl)-N-[(pyridin-3-yl)methyl]-1,3-oxazole-4-carboxamide

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

V018-7444

Molecular Formula

C26H22F4N4O2 (C26 H22 F4 N4 O2)

Compound Name

2-({[(3-fluorophenyl)methyl]({[3-(trifluoromethyl)phenyl]methyl})amino}methyl)-N-[(pyridin-3-yl)methyl]-1,3-oxazole-4-carboxamide

IUPAC name

2-({[(3-fluorophenyl)methyl]({[3-(trifluoromethyl)phenyl]methyl})amino}methyl)-N-[(pyridin-3-yl)methyl]-13-oxazole-4-carboxamide

SMILES

O=C(c1coc(CN(Cc2cc(C(F)(F)F)ccc2)Cc2cccc(F)c2)n1)NCc1cnccc1

InChI

InChI=1S/C26H22F4N4O2/c27-22-8-2-5-19(11-22)15-34(14-18-4-1-7-21(10-18)26(28,29)30)16-24-33-23(17-36-24)25(35)32-13-20-6-3-9-31-12-20/h1-12,17H,13-16H2,(H,32,35)

InChI Key

FGVYOYGWXNYUIJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19833152

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

498.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.954

Distribution Coefficient, logD

3.954

Water Solubility, LogSw

-3.95

Polar Surface Area

56.016

Acid Dissociation Constant (pKa)

13.29

Base Dissociation Constant (pKb)

3.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with V018-7444 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-7444?
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What is the minimum amount of V018-7444 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-7444
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-7444
  • 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 V018-7444 available by request