C532-1717 Screening compound: N-{3-[benzyl(butyl)amino]propyl}-3-methyl-1-phenyl-1H-pyrazole-5-carboxamide

C532-1717 Screening compound: N-{3-[benzyl(butyl)amino]propyl}-3-methyl-1-phenyl-1H-pyrazole-5-carboxamide
C532-1717 Screening compound: N-{3-[benzyl(butyl)amino]propyl}-3-methyl-1-phenyl-1H-pyrazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C532-1717
N-{3-[benzyl(butyl)amino]propyl}-3-methyl-1-phenyl-1H-pyrazole-5-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

C532-1717

Molecular Formula

C25H32N4O (C25 H32 N4 O)

Compound Name

N-{3-[benzyl(butyl)amino]propyl}-3-methyl-1-phenyl-1H-pyrazole-5-carboxamide

IUPAC name

N-{3-[benzyl(butyl)amino]propyl}-3-methyl-1-phenyl-1H-pyrazole-5-carboxamide

SMILES

CCCCN(CCCNC(c1cc(C)nn1-c1ccccc1)=O)Cc1ccccc1

InChI

InChI=1S/C25H32N4O/c1-3-4-17-28(20-22-12-7-5-8-13-22)18-11-16-26-25(30)24-19-21(2)27-29(24)23-14-9-6-10-15-23/h5-10,12-15,19H,3-4,11,16-18,20H2,1-2H3,(H,26,30)

InChI Key

RDPFARKSOUINEU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14768174

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.037

Distribution Coefficient, logD

2.475

Water Solubility, LogSw

-3.74

Polar Surface Area

41.334

Acid Dissociation Constant (pKa)

15.87

Base Dissociation Constant (pKb)

8.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

C532-1717 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C532-1717 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C532-1717?
Check Price and Availability of C532-1717, 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 C532-1717 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C532-1717
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C532-1717
  • 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 C532-1717 available by request