C883-0851 Screening compound: 1-{1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperidine-3-carbonyl}-2,3-dihydro-1H-indole

C883-0851 Screening compound: 1-{1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperidine-3-carbonyl}-2,3-dihydro-1H-indole
C883-0851 Screening compound: 1-{1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperidine-3-carbonyl}-2,3-dihydro-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound C883-0851
1-{1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperidine-3-carbonyl}-2,3-dihydro-1H-indole

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

C883-0851

Molecular Formula

C28H27N5O2 (C28 H27 N5 O2)

Compound Name

1-{1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperidine-3-carbonyl}-2,3-dihydro-1H-indole

IUPAC name

1-{1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperidine-3-carbonyl}-23-dihydro-1H-indole

SMILES

O=C(C(CCC1)CN1C(c1c(-n2cccc2)n(-c2ccccc2)nc1)=O)N(CC1)c2c1cccc2

InChI

InChI=1S/C28H27N5O2/c34-27(32-18-14-21-9-4-5-13-25(21)32)22-10-8-17-31(20-22)28(35)24-19-29-33(23-11-2-1-3-12-23)26(24)30-15-6-7-16-30/h1-7,9,11-13,15-16,19,22H,8,10,14,17-18,20H2/t22-/m0/s1

InChI Key

WKDDSDYSLXPCLD-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD14804993

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.340

Distribution Coefficient, logD

4.340

Water Solubility, LogSw

-4.25

Polar Surface Area

49.356

Acid Dissociation Constant (pKa)

20.98

Base Dissociation Constant (pKb)

0.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

C883-0851 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
  • Endocrine
Targets:
  • GPCR
  • Others
Mechanism of action:
  • Receptor's ligands
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with C883-0851 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C883-0851?
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What is the minimum amount of C883-0851 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C883-0851
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C883-0851
  • 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 C883-0851 available by request