C249-0201 Screening compound: (4Z)-1-(3-chloro-4-methoxyphenyl)-2-(ethylsulfanyl)-4-[(2-methylphenyl)methylidene]-4,5-dihydro-1H-imidazol-5-one

C249-0201 Screening compound: (4Z)-1-(3-chloro-4-methoxyphenyl)-2-(ethylsulfanyl)-4-[(2-methylphenyl)methylidene]-4,5-dihydro-1H-imidazol-5-one
C249-0201 Screening compound: (4Z)-1-(3-chloro-4-methoxyphenyl)-2-(ethylsulfanyl)-4-[(2-methylphenyl)methylidene]-4,5-dihydro-1H-imidazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C249-0201
(4Z)-1-(3-chloro-4-methoxyphenyl)-2-(ethylsulfanyl)-4-[(2-methylphenyl)methylidene]-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

C249-0201

Molecular Formula

C20H19ClN2O2S (C20 H19 ClN2 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CCSC(N(C1=O)c(cc2)cc(Cl)c2OC)=N/C1=C\c1c(C)cccc1

InChI

InChI=1S/C20H19ClN2O2S/c1-4-26-20-22-17(11-14-8-6-5-7-13(14)2)19(24)23(20)15-9-10-18(25-3)16(21)12-15/h5-12H,4H2,1-3H3

InChI Key

BSHYYUWEGRLDNV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14735378

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.871

Distribution Coefficient, logD

4.871

Water Solubility, LogSw

-4.95

Polar Surface Area

33.252

Acid Dissociation Constant (pKa)

27.63

Base Dissociation Constant (pKb)

1.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with C249-0201 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C249-0201?
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What is the minimum amount of C249-0201 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C249-0201
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C249-0201
  • 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 C249-0201 available by request