C197-0284 Screening compound: N-[3-(4-methylpiperazin-1-yl)propyl]-3-[2-(1-oxo-1,2-dihydroisoquinolin-2-yl)acetamido]propanamide

C197-0284 Screening compound: N-[3-(4-methylpiperazin-1-yl)propyl]-3-[2-(1-oxo-1,2-dihydroisoquinolin-2-yl)acetamido]propanamide
C197-0284 Screening compound: N-[3-(4-methylpiperazin-1-yl)propyl]-3-[2-(1-oxo-1,2-dihydroisoquinolin-2-yl)acetamido]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C197-0284
N-[3-(4-methylpiperazin-1-yl)propyl]-3-[2-(1-oxo-1,2-dihydroisoquinolin-2-yl)acetamido]propanamide

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

C197-0284

Molecular Formula

C22H31N5O3 (C22 H31 N5 O3)

Compound Name

N-[3-(4-methylpiperazin-1-yl)propyl]-3-[2-(1-oxo-1,2-dihydroisoquinolin-2-yl)acetamido]propanamide

IUPAC name

N-[3-(4-methylpiperazin-1-yl)propyl]-3-[2-(1-oxo-12-dihydroisoquinolin-2-yl)acetamido]propanamide

SMILES

CN1CCN(CCCNC(CCNC(CN(C=Cc2c3cccc2)C3=O)=O)=O)CC1

InChI

InChI=1S/C22H31N5O3/c1-25-13-15-26(16-14-25)11-4-9-23-20(28)7-10-24-21(29)17-27-12-8-18-5-2-3-6-19(18)22(27)30/h2-3,5-6,8,12H,4,7,9-11,13-17H2,1H3,(H,23,28)(H,24,29)

InChI Key

YMADYMPOCXTUFR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14725304

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-1.079

Distribution Coefficient, logD

-2.283

Water Solubility, LogSw

-2.12

Polar Surface Area

71.766

Acid Dissociation Constant (pKa)

15.45

Base Dissociation Constant (pKb)

8.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

C197-0284 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with C197-0284 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C197-0284?
Check Price and Availability of C197-0284, 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 C197-0284 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C197-0284
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C197-0284
  • 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 C197-0284 available by request