C249-0240 Screening compound: (4Z)-1-(3-chloro-4-methoxyphenyl)-2-(methylsulfanyl)-4-[(thiophen-3-yl)methylidene]-4,5-dihydro-1H-imidazol-5-one

C249-0240 Screening compound: (4Z)-1-(3-chloro-4-methoxyphenyl)-2-(methylsulfanyl)-4-[(thiophen-3-yl)methylidene]-4,5-dihydro-1H-imidazol-5-one
C249-0240 Screening compound: (4Z)-1-(3-chloro-4-methoxyphenyl)-2-(methylsulfanyl)-4-[(thiophen-3-yl)methylidene]-4,5-dihydro-1H-imidazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C249-0240
(4Z)-1-(3-chloro-4-methoxyphenyl)-2-(methylsulfanyl)-4-[(thiophen-3-yl)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

C249-0240

Molecular Formula

C16H13ClN2O2S2 (C16 H13 ClN2 O2 S2)

Compound Name

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

IUPAC name

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

SMILES

COc(ccc(N(C1=O)C(SC)=N/C1=C\c1cscc1)c1)c1Cl

InChI

InChI=1S/C16H13ClN2O2S2/c1-21-14-4-3-11(8-12(14)17)19-15(20)13(18-16(19)22-2)7-10-5-6-23-9-10/h3-9H,1-2H3

InChI Key

BLAYMICCHATQHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14735402

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.88

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

3.667

Distribution Coefficient, logD

3.667

Water Solubility, LogSw

-4.06

Polar Surface Area

34.270

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with C249-0240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C249-0240?
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What is the minimum amount of C249-0240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C249-0240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C249-0240
  • 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 C249-0240 available by request