Z603-4014 Screening compound: 3-cyano-N-(1-cyclopropanecarbonylpyrrolidin-3-yl)benzamide

Z603-4014 Screening compound: 3-cyano-N-(1-cyclopropanecarbonylpyrrolidin-3-yl)benzamide
Z603-4014 Screening compound: 3-cyano-N-(1-cyclopropanecarbonylpyrrolidin-3-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Z603-4014
3-cyano-N-(1-cyclopropanecarbonylpyrrolidin-3-yl)benzamide

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

Z603-4014

Molecular Formula

C16H17N3O2 (C16 H17 N3 O2)

Compound Name

3-cyano-N-(1-cyclopropanecarbonylpyrrolidin-3-yl)benzamide

IUPAC name

3-cyano-N-(1-cyclopropanecarbonylpyrrolidin-3-yl)benzamide

SMILES

N#Cc1cccc(C(NC(CC2)CN2C(C2CC2)=O)=O)c1

InChI

InChI=1S/C16H17N3O2/c17-9-11-2-1-3-13(8-11)15(20)18-14-6-7-19(10-14)16(21)12-4-5-12/h1-3,8,12,14H,4-7,10H2,(H,18,20)/t14-/m0/s1

InChI Key

LFICPPPTFKKNQH-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27640046

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

283.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.238

Distribution Coefficient, logD

1.238

Water Solubility, LogSw

-2.04

Polar Surface Area

58.712

Acid Dissociation Constant (pKa)

13.31

Base Dissociation Constant (pKb)

-1.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.80

Z603-4014 in Drug Discovery

Included in Screening Libraries

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

Fragments Library (11262 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

SmartTM Library (51161 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Z603-4014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Z603-4014?
Check Price and Availability of Z603-4014, 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 Z603-4014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Z603-4014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Z603-4014
  • 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 Z603-4014 available by request