C535-0997 Screening compound: 1-[3-(4-chlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]-N,N-dipropylpiperidine-4-carboxamide

C535-0997 Screening compound: 1-[3-(4-chlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]-N,N-dipropylpiperidine-4-carboxamide
C535-0997 Screening compound: 1-[3-(4-chlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]-N,N-dipropylpiperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C535-0997
1-[3-(4-chlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]-N,N-dipropylpiperidine-4-carboxamide

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

C535-0997

Molecular Formula

C26H34ClN5O (C26 H34 ClN5 O)

Compound Name

1-[3-(4-chlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]-N,N-dipropylpiperidine-4-carboxamide

IUPAC name

1-[3-(4-chlorophenyl)-25-dimethylpyrazolo[15-a]pyrimidin-7-yl]-NN-dipropylpiperidine-4-carboxamide

SMILES

CCCN(CCC)C(C(CC1)CCN1c(n1nc2C)cc(C)nc1c2-c(cc1)ccc1Cl)=O

InChI

InChI=1S/C26H34ClN5O/c1-5-13-31(14-6-2)26(33)21-11-15-30(16-12-21)23-17-18(3)28-25-24(19(4)29-32(23)25)20-7-9-22(27)10-8-20/h7-10,17,21H,5-6,11-16H2,1-4H3

InChI Key

XZMQPUCDGHILNS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14768671

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.04

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.474

Distribution Coefficient, logD

3.967

Water Solubility, LogSw

-6.16

Polar Surface Area

39.296

Acid Dissociation Constant (pKa)

23.23

Base Dissociation Constant (pKb)

8.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

C535-0997 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

GABA Library (7115 compounds)

Human Proteases Annotated Library (2868 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C535-0997 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C535-0997?
Check Price and Availability of C535-0997, 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 C535-0997 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C535-0997
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C535-0997
  • 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 C535-0997 available by request