F919-0164 Screening compound: N-butyl-2-{4-[3-methanesulfonamido-4-(piperazin-1-yl)benzoyl]piperazin-1-yl}acetamide

F919-0164 Screening compound: N-butyl-2-{4-[3-methanesulfonamido-4-(piperazin-1-yl)benzoyl]piperazin-1-yl}acetamide
F919-0164 Screening compound: N-butyl-2-{4-[3-methanesulfonamido-4-(piperazin-1-yl)benzoyl]piperazin-1-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F919-0164
N-butyl-2-{4-[3-methanesulfonamido-4-(piperazin-1-yl)benzoyl]piperazin-1-yl}acetamide

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

F919-0164

Molecular Formula

C22H36N6O4S (C22 H36 N6 O4 S)

Compound Name

N-butyl-2-{4-[3-methanesulfonamido-4-(piperazin-1-yl)benzoyl]piperazin-1-yl}acetamide

IUPAC name

N-butyl-2-{4-[3-methanesulfonamido-4-(piperazin-1-yl)benzoyl]piperazin-1-yl}acetamide

SMILES

CCCCNC(CN(CC1)CCN1C(c(cc1)cc(NS(C)(=O)=O)c1N1CCNCC1)=O)=O

InChI

InChI=1S/C22H36N6O4S/c1-3-4-7-24-21(29)17-26-12-14-28(15-13-26)22(30)18-5-6-20(27-10-8-23-9-11-27)19(16-18)25-33(2,31)32/h5-6,16,23,25H,3-4,7-15,17H2,1-2H3,(H,24,29)

InChI Key

QHOLLJCFETUOCZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14971666

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

480.63

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.178

Distribution Coefficient, logD

0.178

Water Solubility, LogSw

-2.49

Polar Surface Area

101.293

Acid Dissociation Constant (pKa)

6.93

Base Dissociation Constant (pKb)

8.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.60

F919-0164 in Drug Discovery

Included in Screening Libraries

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

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F919-0164 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F919-0164?
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What is the minimum amount of F919-0164 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F919-0164
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F919-0164
  • 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 F919-0164 available by request