C795-0520 Screening compound: N-(2,4-dimethylphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}-4-piperidinecarboxamide

C795-0520 Screening compound: N-(2,4-dimethylphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}-4-piperidinecarboxamide
C795-0520 Screening compound: N-(2,4-dimethylphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C795-0520
N-(2,4-dimethylphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}-4-piperidinecarboxamide

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

C795-0520

Molecular Formula

C28H31N5O (C28 H31 N5 O)

Compound Name

N-(2,4-dimethylphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}-4-piperidinecarboxamide

IUPAC name

N-(24-dimethylphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidine-4-carboxamide

SMILES

Cc(cc1)cc(C)c1NC(C1CCN(Cc2c(-n3cccc3)n(-c3ccccc3)nc2)CC1)=O

InChI

InChI=1S/C28H31N5O/c1-21-10-11-26(22(2)18-21)30-27(34)23-12-16-31(17-13-23)20-24-19-29-33(25-8-4-3-5-9-25)28(24)32-14-6-7-15-32/h3-11,14-15,18-19,23H,12-13,16-17,20H2,1-2H3,(H,30,34)

InChI Key

JWEWUQZVYBBBMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14796940

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.59

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.036

Distribution Coefficient, logD

1.669

Water Solubility, LogSw

-4.34

Polar Surface Area

43.221

Acid Dissociation Constant (pKa)

11.72

Base Dissociation Constant (pKb)

10.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.57

C795-0520 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

SH2 Library (10483 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C795-0520 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C795-0520?
Check Price and Availability of C795-0520, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C795-0520 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C795-0520
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C795-0520
  • 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 C795-0520 available by request