V026-6549 Screening compound: N-{2-[3-(2-chlorophenyl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]thiophene-2-carboxamide

V026-6549 Screening compound: N-{2-[3-(2-chlorophenyl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]thiophene-2-carboxamide
V026-6549 Screening compound: N-{2-[3-(2-chlorophenyl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-6549
N-{2-[3-(2-chlorophenyl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]thiophene-2-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

V026-6549

Molecular Formula

C28H28ClFN4O3S (C28 H28 ClFN4 O3 S)

Compound Name

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

IUPAC name

N-{2-[3-(2-chlorophenyl)-5-(2-fluorophenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]thiophene-2-carboxamide

SMILES

O=C(CN(CCN1CCOCC1)C(c1cccs1)=O)N(C(C1)c(cccc2)c2F)N=C1c(cccc1)c1Cl

InChI

InChI=1S/C28H28ClFN4O3S/c29-22-8-3-1-6-20(22)24-18-25(21-7-2-4-9-23(21)30)34(31-24)27(35)19-33(28(36)26-10-5-17-38-26)12-11-32-13-15-37-16-14-32/h1-10,17,25H,11-16,18-19H2/t25-/m1/s1

InChI Key

BMEGNVZZPQNHET-RUZDIDTESA-N

MDL Number (MFCD)

MFCD19801370

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

555.07

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.468

Distribution Coefficient, logD

4.459

Water Solubility, LogSw

-4.63

Polar Surface Area

55.686

Acid Dissociation Constant (pKa)

18.73

Base Dissociation Constant (pKb)

5.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.10

References: we are preparing a list of scientific research reports with V026-6549 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-6549?
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What is the minimum amount of V026-6549 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-6549
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-6549
  • 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 V026-6549 available by request