V025-3126 Screening compound: N-{[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(3-fluorophenyl)methyl]cyclobutanecarboxamide

V025-3126 Screening compound: N-{[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(3-fluorophenyl)methyl]cyclobutanecarboxamide
V025-3126 Screening compound: N-{[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(3-fluorophenyl)methyl]cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-3126
N-{[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(3-fluorophenyl)methyl]cyclobutanecarboxamide

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

V025-3126

Molecular Formula

C22H21Cl2FN2O2 (C22 H21 Cl2 FN2 O2)

Compound Name

N-{[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(3-fluorophenyl)methyl]cyclobutanecarboxamide

IUPAC name

N-{[3-(34-dichlorophenyl)-45-dihydro-12-oxazol-5-yl]methyl}-N-[(3-fluorophenyl)methyl]cyclobutanecarboxamide

SMILES

O=C(C1CCC1)N(CC(C1)ON=C1c(cc1)cc(Cl)c1Cl)Cc1cc(F)ccc1

InChI

InChI=1S/C22H21Cl2FN2O2/c23-19-8-7-16(10-20(19)24)21-11-18(29-26-21)13-27(22(28)15-4-2-5-15)12-14-3-1-6-17(25)9-14/h1,3,6-10,15,18H,2,4-5,11-13H2/t18-/m0/s1

InChI Key

QILCUKYUSNKCLV-SFHVURJKSA-N

MDL Number (MFCD)

MFCD19798138

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.148

Distribution Coefficient, logD

5.148

Water Solubility, LogSw

-5.87

Polar Surface Area

39.537

Acid Dissociation Constant (pKa)

22.29

Base Dissociation Constant (pKb)

-3.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with V025-3126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-3126?
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What is the minimum amount of V025-3126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-3126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-3126
  • 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 V025-3126 available by request