8018-2227 Screening compound: 1-(4-chlorophenyl)-3-{4-[4-(trifluoromethoxy)anilino]piperidino}dihydro-1H-pyrrole-2,5-dione

8018-2227 Screening compound: 1-(4-chlorophenyl)-3-{4-[4-(trifluoromethoxy)anilino]piperidino}dihydro-1H-pyrrole-2,5-dione
8018-2227 Screening compound: 1-(4-chlorophenyl)-3-{4-[4-(trifluoromethoxy)anilino]piperidino}dihydro-1H-pyrrole-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-2227
1-(4-chlorophenyl)-3-{4-[4-(trifluoromethoxy)anilino]piperidino}dihydro-1H-pyrrole-2,5-dione

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

8018-2227

Molecular Formula

C22H21ClF3N3O3 (C22 H21 ClF3 N3 O3)

Compound Name

1-(4-chlorophenyl)-3-{4-[4-(trifluoromethoxy)anilino]piperidino}dihydro-1H-pyrrole-2,5-dione

IUPAC name

n/a

SMILES

O=C(CC(C1=O)N(CC2)CCC2Nc(cc2)ccc2OC(F)(F)F)N1c(cc1)ccc1Cl

InChI

InChI=1S/C22H21ClF3N3O3/c23-14-1-5-17(6-2-14)29-20(30)13-19(21(29)31)28-11-9-16(10-12-28)27-15-3-7-18(8-4-15)32-22(24,25)26/h1-8,16,19,27H,9-13H2/t19-/m1/s1

InChI Key

ZZVCWIMICOFQNJ-LJQANCHMSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.88

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.028

Distribution Coefficient, logD

4.007

Water Solubility, LogSw

-4.65

Polar Surface Area

47.692

Acid Dissociation Constant (pKa)

17.30

Base Dissociation Constant (pKb)

8.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with 8018-2227 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-2227?
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What is the minimum amount of 8018-2227 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-2227
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-2227
  • 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 8018-2227 available by request