C249-0571 Screening compound: ethyl 4-[(4Z)-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-[(2-methylphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl]benzoate

C249-0571 Screening compound: ethyl 4-[(4Z)-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-[(2-methylphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl]benzoate
C249-0571 Screening compound: ethyl 4-[(4Z)-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-[(2-methylphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C249-0571
ethyl 4-[(4Z)-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-[(2-methylphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl]benzoate

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

C249-0571

Molecular Formula

C24H24N2O5S (C24 H24 N2 O5 S)

Compound Name

ethyl 4-[(4Z)-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-[(2-methylphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl]benzoate

IUPAC name

ethyl 4-[(4Z)-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-[(2-methylphenyl)methylidene]-5-oxo-45-dihydro-1H-imidazol-1-yl]benzoate

SMILES

CCOC(CSC(N(C1=O)c(cc2)ccc2C(OCC)=O)=N/C1=C\c1c(C)cccc1)=O

InChI

InChI=1S/C24H24N2O5S/c1-4-30-21(27)15-32-24-25-20(14-18-9-7-6-8-16(18)3)22(28)26(24)19-12-10-17(11-13-19)23(29)31-5-2/h6-14H,4-5,15H2,1-3H3

InChI Key

XQQMJCQHVMAZMI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14735618

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.53

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.720

Distribution Coefficient, logD

4.720

Water Solubility, LogSw

-4.48

Polar Surface Area

66.534

Acid Dissociation Constant (pKa)

27.63

Base Dissociation Constant (pKb)

1.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with C249-0571 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C249-0571?
Check Price and Availability of C249-0571, 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 C249-0571 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C249-0571
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C249-0571
  • 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 C249-0571 available by request