C305-1345 Screening compound: 2-{3-[(2-chloro-4-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl}-N-(2-methylpropyl)acetamide

C305-1345 Screening compound: 2-{3-[(2-chloro-4-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl}-N-(2-methylpropyl)acetamide
C305-1345 Screening compound: 2-{3-[(2-chloro-4-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl}-N-(2-methylpropyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C305-1345
2-{3-[(2-chloro-4-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl}-N-(2-methylpropyl)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

C305-1345

Molecular Formula

C16H21ClFN3O2 (C16 H21 ClFN3 O2)

Compound Name

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

IUPAC name

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

SMILES

CC(C)CNC(CN(CCN1Cc(ccc(F)c2)c2Cl)C1=O)=O

InChI

InChI=1S/C16H21ClFN3O2/c1-11(2)8-19-15(22)10-21-6-5-20(16(21)23)9-12-3-4-13(18)7-14(12)17/h3-4,7,11H,5-6,8-10H2,1-2H3,(H,19,22)

InChI Key

KGJAEFVOVVWTOW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29031373

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.81

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.643

Distribution Coefficient, logD

2.643

Water Solubility, LogSw

-3.43

Polar Surface Area

45.352

Acid Dissociation Constant (pKa)

16.19

Base Dissociation Constant (pKb)

6.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

C305-1345 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

SmartTM Library (51161 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C305-1345 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C305-1345?
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What is the minimum amount of C305-1345 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C305-1345
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C305-1345
  • 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 C305-1345 available by request