C249-0256 Screening compound: (4Z)-1-(3-chloro-4-methoxyphenyl)-4-[(2-fluorophenyl)methylidene]-2-(methylsulfanyl)-4,5-dihydro-1H-imidazol-5-one

C249-0256 Screening compound: (4Z)-1-(3-chloro-4-methoxyphenyl)-4-[(2-fluorophenyl)methylidene]-2-(methylsulfanyl)-4,5-dihydro-1H-imidazol-5-one
C249-0256 Screening compound: (4Z)-1-(3-chloro-4-methoxyphenyl)-4-[(2-fluorophenyl)methylidene]-2-(methylsulfanyl)-4,5-dihydro-1H-imidazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C249-0256
(4Z)-1-(3-chloro-4-methoxyphenyl)-4-[(2-fluorophenyl)methylidene]-2-(methylsulfanyl)-4,5-dihydro-1H-imidazol-5-one

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

C249-0256

Molecular Formula

C18H14ClFN2O2S (C18 H14 ClFN2 O2 S)

Compound Name

(4Z)-1-(3-chloro-4-methoxyphenyl)-4-[(2-fluorophenyl)methylidene]-2-(methylsulfanyl)-4,5-dihydro-1H-imidazol-5-one

IUPAC name

(4Z)-1-(3-chloro-4-methoxyphenyl)-4-[(2-fluorophenyl)methylidene]-2-(methylsulfanyl)-45-dihydro-1H-imidazol-5-one

SMILES

COc(ccc(N(C1=O)C(SC)=N/C1=C\c(cccc1)c1F)c1)c1Cl

InChI

InChI=1S/C18H14ClFN2O2S/c1-24-16-8-7-12(10-13(16)19)22-17(23)15(21-18(22)25-2)9-11-5-3-4-6-14(11)20/h3-10H,1-2H3

InChI Key

SIBSVPSOKHVCDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14735414

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.84

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.094

Distribution Coefficient, logD

4.094

Water Solubility, LogSw

-4.52

Polar Surface Area

33.252

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

0.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with C249-0256 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C249-0256?
Check Price and Availability of C249-0256, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C249-0256 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C249-0256
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C249-0256
  • 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 C249-0256 available by request