C305-1852 Screening compound: 2-{3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl}-N-{[4-(piperidin-1-yl)phenyl]methyl}acetamide

C305-1852 Screening compound: 2-{3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl}-N-{[4-(piperidin-1-yl)phenyl]methyl}acetamide
C305-1852 Screening compound: 2-{3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl}-N-{[4-(piperidin-1-yl)phenyl]methyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C305-1852
2-{3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl}-N-{[4-(piperidin-1-yl)phenyl]methyl}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

C305-1852

Molecular Formula

C24H29FN4O2 (C24 H29 FN4 O2)

Compound Name

2-{3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl}-N-{[4-(piperidin-1-yl)phenyl]methyl}acetamide

IUPAC name

2-{3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl}-N-{[4-(piperidin-1-yl)phenyl]methyl}acetamide

SMILES

O=C(CN(CCN1Cc(cccc2)c2F)C1=O)NCc(cc1)ccc1N1CCCCC1

InChI

InChI=1S/C24H29FN4O2/c25-22-7-3-2-6-20(22)17-28-14-15-29(24(28)31)18-23(30)26-16-19-8-10-21(11-9-19)27-12-4-1-5-13-27/h2-3,6-11H,1,4-5,12-18H2,(H,26,30)

InChI Key

PVJQTKNHSAAEMT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29026291

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.446

Distribution Coefficient, logD

3.415

Water Solubility, LogSw

-3.41

Polar Surface Area

48.533

Acid Dissociation Constant (pKa)

14.15

Base Dissociation Constant (pKb)

6.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

C305-1852 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C305-1852 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C305-1852?
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What is the minimum amount of C305-1852 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C305-1852
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C305-1852
  • 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 C305-1852 available by request