V027-0214 Screening compound: N-{[3-(5-chloro-2-furyl)-4,5-dihydro-5-isoxazolyl]methyl}-N'-ethyl-N-[3-(trifluoromethyl)benzyl]urea

V027-0214 Screening compound: N-{[3-(5-chloro-2-furyl)-4,5-dihydro-5-isoxazolyl]methyl}-N'-ethyl-N-[3-(trifluoromethyl)benzyl]urea
V027-0214 Screening compound: N-{[3-(5-chloro-2-furyl)-4,5-dihydro-5-isoxazolyl]methyl}-N'-ethyl-N-[3-(trifluoromethyl)benzyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-0214
N-{[3-(5-chloro-2-furyl)-4,5-dihydro-5-isoxazolyl]methyl}-N'-ethyl-N-[3-(trifluoromethyl)benzyl]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

V027-0214

Molecular Formula

C19H19ClF3N3O3 (C19 H19 ClF3 N3 O3)

Compound Name

N-{[3-(5-chloro-2-furyl)-4,5-dihydro-5-isoxazolyl]methyl}-N'-ethyl-N-[3-(trifluoromethyl)benzyl]urea

IUPAC name

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

SMILES

CCNC(N(CC(C1)ON=C1c(o1)ccc1Cl)Cc1cc(C(F)(F)F)ccc1)=O

InChI

InChI=1S/C19H19ClF3N3O3/c1-2-24-18(27)26(10-12-4-3-5-13(8-12)19(21,22)23)11-14-9-15(25-29-14)16-6-7-17(20)28-16/h3-8,14H,2,9-11H2,1H3,(H,24,27)/t14-/m0/s1

InChI Key

BHTDVHVKRWTDMV-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD19795546

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

429.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.061

Distribution Coefficient, logD

4.061

Water Solubility, LogSw

-4.42

Polar Surface Area

57.806

Acid Dissociation Constant (pKa)

16.86

Base Dissociation Constant (pKb)

1.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.80

References: we are preparing a list of scientific research reports with V027-0214 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-0214?
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What is the minimum amount of V027-0214 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-0214
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-0214
  • 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 V027-0214 available by request