Screening compound: InChI=1S/C28H25ClN4O3/c29-23-7-4-8-25(18-23)32-27(19-26(30-32)22-9-11-24(12-10-22)33(35)36)28(34)31-15-13-21(14-16-31)17-20-5-2-1-3-6-20/h1-12,18-19,21H,13-17H2

Screening compound: InChI=1S/C28H25ClN4O3/c29-23-7-4-8-25(18-23)32-27(19-26(30-32)22-9-11-24(12-10-22)33(35)36)28(34)31-15-13-21(14-16-31)17-20-5-2-1-3-6-20/h1-12,18-19,21H,13-17H2
Screening compound: InChI=1S/C28H25ClN4O3/c29-23-7-4-8-25(18-23)32-27(19-26(30-32)22-9-11-24(12-10-22)33(35)36)28(34)31-15-13-21(14-16-31)17-20-5-2-1-3-6-20/h1-12,18-19,21H,13-17H2 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C28H25ClN4O3/c29-23-7-4-8-25(18-23)32-27(19-26(30-32)22-9-11-24(12-10-22)33(35)36)28(34)31-15-13-21(14-16-31)17-20-5-2-1-3-6-20/h1-12,18-19,21H,13-17H2

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

V016-7302

Molecular Formula

C28H25ClN4O3 (C28 H25 ClN4 O3)

Compound Name

4-benzyl-1-[1-(3-chlorophenyl)-3-(4-nitrophenyl)-1H-pyrazole-5-carbonyl]piperidine

IUPAC name

4-benzyl-1-[1-(3-chlorophenyl)-3-(4-nitrophenyl)-1H-pyrazole-5-carbonyl]piperidine

SMILES

[O-][N+](c(cc1)ccc1-c(cc1C(N2CCC(Cc3ccccc3)CC2)=O)nn1-c1cccc(Cl)c1)=O

InChI

InChI=1S/C28H25ClN4O3/c29-23-7-4-8-25(18-23)32-27(19-26(30-32)22-9-11-24(12-10-22)33(35)36)28(34)31-15-13-21(14-16-31)17-20-5-2-1-3-6-20/h1-12,18-19,21H,13-17H2

InChI Key

CJZZNEWWIPYQNE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14242697

InChI=1S/C28H25ClN4O3/c29-23-7-4-8-25(18-23)32-27(19-26(30-32)22-9-11-24(12-10-22)33(35)36)28(34)31-15-13-21(14-16-31)17-20-5-2-1-3-6-20/h1-12,18-19,21H,13-17H2 in Drug Discovery

Included in Screening Libraries

Proline Kinase Library (2105 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with InChI=1S/C28H25ClN4O3/c29-23-7-4-8-25(18-23)32-27(19-26(30-32)22-9-11-24(12-10-22)33(35)36)28(34)31-15-13-21(14-16-31)17-20-5-2-1-3-6-20/h1-12,18-19,21H,13-17H2 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for InChI=1S/C28H25ClN4O3/c29-23-7-4-8-25(18-23)32-27(19-26(30-32)22-9-11-24(12-10-22)33(35)36)28(34)31-15-13-21(14-16-31)17-20-5-2-1-3-6-20/h1-12,18-19,21H,13-17H2
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for InChI=1S/C28H25ClN4O3/c29-23-7-4-8-25(18-23)32-27(19-26(30-32)22-9-11-24(12-10-22)33(35)36)28(34)31-15-13-21(14-16-31)17-20-5-2-1-3-6-20/h1-12,18-19,21H,13-17H2
  • 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 InChI=1S/C28H25ClN4O3/c29-23-7-4-8-25(18-23)32-27(19-26(30-32)22-9-11-24(12-10-22)33(35)36)28(34)31-15-13-21(14-16-31)17-20-5-2-1-3-6-20/h1-12,18-19,21H,13-17H2 available by request