C707-0525 Screening compound: 2-(5-chloro-3-phenyl-1H-indazol-1-yl)-1-(3,5-dimethylpiperidin-1-yl)propan-1-one

C707-0525 Screening compound: 2-(5-chloro-3-phenyl-1H-indazol-1-yl)-1-(3,5-dimethylpiperidin-1-yl)propan-1-one
C707-0525 Screening compound: 2-(5-chloro-3-phenyl-1H-indazol-1-yl)-1-(3,5-dimethylpiperidin-1-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C707-0525
2-(5-chloro-3-phenyl-1H-indazol-1-yl)-1-(3,5-dimethylpiperidin-1-yl)propan-1-one

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

C707-0525

Molecular Formula

C23H26ClN3O (C23 H26 ClN3 O)

Compound Name

2-(5-chloro-3-phenyl-1H-indazol-1-yl)-1-(3,5-dimethylpiperidin-1-yl)propan-1-one

IUPAC name

2-(5-chloro-3-phenyl-1H-indazol-1-yl)-1-(35-dimethylpiperidin-1-yl)propan-1-one

SMILES

CC(C(N1CC(C)CC(C)C1)=O)n(c(cc1)c2cc1Cl)nc2-c1ccccc1

InChI

InChI=1S/C23H26ClN3O/c1-15-11-16(2)14-26(13-15)23(28)17(3)27-21-10-9-19(24)12-20(21)22(25-27)18-7-5-4-6-8-18/h4-10,12,15-17H,11,13-14H2,1-3H3

InChI Key

JYZIECIGLKAAAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14786668

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.93

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.262

Distribution Coefficient, logD

5.262

Water Solubility, LogSw

-5.83

Polar Surface Area

30.821

Acid Dissociation Constant (pKa)

21.86

Base Dissociation Constant (pKb)

4.09

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

39.10

C707-0525 in Drug Discovery

Included in Screening Libraries

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

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with C707-0525 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C707-0525?
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What is the minimum amount of C707-0525 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C707-0525
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C707-0525
  • 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 C707-0525 available by request