F972-0041 Screening compound: N-(4-{2-[5-(4-methylpiperidine-1-carbonyl)-1H-1,3-benzodiazol-2-yl]ethyl}phenyl)propanamide

F972-0041 Screening compound: N-(4-{2-[5-(4-methylpiperidine-1-carbonyl)-1H-1,3-benzodiazol-2-yl]ethyl}phenyl)propanamide
F972-0041 Screening compound: N-(4-{2-[5-(4-methylpiperidine-1-carbonyl)-1H-1,3-benzodiazol-2-yl]ethyl}phenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F972-0041
N-(4-{2-[5-(4-methylpiperidine-1-carbonyl)-1H-1,3-benzodiazol-2-yl]ethyl}phenyl)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

F972-0041

Molecular Formula

C25H30N4O2 (C25 H30 N4 O2)

Compound Name

N-(4-{2-[5-(4-methylpiperidine-1-carbonyl)-1H-1,3-benzodiazol-2-yl]ethyl}phenyl)propanamide

IUPAC name

N-(4-{2-[5-(4-methylpiperidine-1-carbonyl)-1H-13-benzodiazol-2-yl]ethyl}phenyl)propanamide

SMILES

CCC(Nc1ccc(CCc2nc(cc(cc3)C(N4CCC(C)CC4)=O)c3[nH]2)cc1)=O

InChI

InChI=1S/C25H30N4O2/c1-3-24(30)26-20-8-4-18(5-9-20)6-11-23-27-21-10-7-19(16-22(21)28-23)25(31)29-14-12-17(2)13-15-29/h4-5,7-10,16-17H,3,6,11-15H2,1-2H3,(H,26,30)(H,27,28)

InChI Key

UBVAAQURCLGQCI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27206286

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.997

Distribution Coefficient, logD

3.973

Water Solubility, LogSw

-4.10

Polar Surface Area

60.046

Acid Dissociation Constant (pKa)

10.80

Base Dissociation Constant (pKb)

6.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

F972-0041 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F972-0041 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F972-0041?
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What is the minimum amount of F972-0041 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F972-0041
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F972-0041
  • 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 F972-0041 available by request