V002-6193 Screening compound: N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-2-fluoro-N-methylbenzamide

V002-6193 Screening compound: N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-2-fluoro-N-methylbenzamide
V002-6193 Screening compound: N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-2-fluoro-N-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-6193
N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-2-fluoro-N-methylbenzamide

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

V002-6193

Molecular Formula

C24H22ClFN4O2 (C24 H22 ClFN4 O2)

Compound Name

N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-2-fluoro-N-methylbenzamide

IUPAC name

N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-2-fluoro-N-methylbenzamide

SMILES

CN(CC(N(C(C1)c(cc2)ccc2Cl)N=C1c1cccn1C)=O)C(c(cccc1)c1F)=O

InChI

InChI=1S/C24H22ClFN4O2/c1-28-13-5-8-21(28)20-14-22(16-9-11-17(25)12-10-16)30(27-20)23(31)15-29(2)24(32)18-6-3-4-7-19(18)26/h3-13,22H,14-15H2,1-2H3/t22-/m0/s1

InChI Key

XUPHPTLJKPCSKV-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19802001

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.92

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.567

Distribution Coefficient, logD

4.567

Water Solubility, LogSw

-5.05

Polar Surface Area

45.426

Acid Dissociation Constant (pKa)

18.75

Base Dissociation Constant (pKb)

-2.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.80

References: we are preparing a list of scientific research reports with V002-6193 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-6193?
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What is the minimum amount of V002-6193 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-6193
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-6193
  • 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 V002-6193 available by request