C250-0898 Screening compound: 4-(3-chlorophenyl)-1-(3-fluorobenzoyl)-2,2-dimethyl-2,5-dihydro-1H-imidazole-5-thione

C250-0898 Screening compound: 4-(3-chlorophenyl)-1-(3-fluorobenzoyl)-2,2-dimethyl-2,5-dihydro-1H-imidazole-5-thione
C250-0898 Screening compound: 4-(3-chlorophenyl)-1-(3-fluorobenzoyl)-2,2-dimethyl-2,5-dihydro-1H-imidazole-5-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound C250-0898
4-(3-chlorophenyl)-1-(3-fluorobenzoyl)-2,2-dimethyl-2,5-dihydro-1H-imidazole-5-thione

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

C250-0898

Molecular Formula

C18H14ClFN2OS (C18 H14 ClFN2 OS)

Compound Name

4-(3-chlorophenyl)-1-(3-fluorobenzoyl)-2,2-dimethyl-2,5-dihydro-1H-imidazole-5-thione

IUPAC name

4-(3-chlorophenyl)-1-(3-fluorobenzoyl)-22-dimethyl-25-dihydro-1H-imidazole-5-thione

SMILES

CC(C)(N(C(c1cc(F)ccc1)=O)C1=S)N=C1c1cccc(Cl)c1

InChI

InChI=1S/C18H14ClFN2OS/c1-18(2)21-15(11-5-3-7-13(19)9-11)17(24)22(18)16(23)12-6-4-8-14(20)10-12/h3-10H,1-2H3

InChI Key

PWXLAVCDSAJTCS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26963664

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.84

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.400

Distribution Coefficient, logD

4.400

Water Solubility, LogSw

-4.64

Polar Surface Area

22.725

Acid Dissociation Constant (pKa)

30.36

Base Dissociation Constant (pKb)

-2.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with C250-0898 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C250-0898?
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What is the minimum amount of C250-0898 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C250-0898
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C250-0898
  • 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 C250-0898 available by request