V026-6546 Screening compound: N-{2-[5-(2-fluorophenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide

V026-6546 Screening compound: N-{2-[5-(2-fluorophenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide
V026-6546 Screening compound: N-{2-[5-(2-fluorophenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-6546
N-{2-[5-(2-fluorophenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide

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

V026-6546

Molecular Formula

C29H36F2N4O3 (C29 H36 F2 N4 O3)

Compound Name

N-{2-[5-(2-fluorophenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide

IUPAC name

N-{2-[5-(2-fluorophenyl)-3-(4-fluorophenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-33-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide

SMILES

CC(C)(C)CC(N(CCN1CCOCC1)CC(N(C(C1)c(cccc2)c2F)N=C1c(cc1)ccc1F)=O)=O

InChI

InChI=1S/C29H36F2N4O3/c1-29(2,3)19-27(36)34(13-12-33-14-16-38-17-15-33)20-28(37)35-26(23-6-4-5-7-24(23)31)18-25(32-35)21-8-10-22(30)11-9-21/h4-11,26H,12-20H2,1-3H3/t26-/m0/s1

InChI Key

RUJFBUMEYFKJKI-SANMLTNESA-N

MDL Number (MFCD)

MFCD19801544

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

526.63

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.536

Distribution Coefficient, logD

4.510

Water Solubility, LogSw

-4.21

Polar Surface Area

54.412

Acid Dissociation Constant (pKa)

19.12

Base Dissociation Constant (pKb)

6.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.30

References: we are preparing a list of scientific research reports with V026-6546 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-6546?
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What is the minimum amount of V026-6546 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-6546
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-6546
  • 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 V026-6546 available by request