C148-0656 Screening compound: N-(4-chlorophenyl)-2-[1-(4-ethoxyphenyl)-3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide

C148-0656 Screening compound: N-(4-chlorophenyl)-2-[1-(4-ethoxyphenyl)-3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide
C148-0656 Screening compound: N-(4-chlorophenyl)-2-[1-(4-ethoxyphenyl)-3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C148-0656
N-(4-chlorophenyl)-2-[1-(4-ethoxyphenyl)-3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide

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

C148-0656

Molecular Formula

C32H35ClFN5O3S (C32 H35 ClFN5 O3 S)

Compound Name

N-(4-chlorophenyl)-2-[1-(4-ethoxyphenyl)-3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide

IUPAC name

N-(4-chlorophenyl)-2-[1-(4-ethoxyphenyl)-3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide

SMILES

CCOc(cc1)ccc1N(C(C(CC(Nc(cc1)ccc1Cl)=O)N1CCCN(CC2)CCN2c(cc2)ccc2F)=O)C1=S

InChI

InChI=1S/C32H35ClFN5O3S/c1-2-42-28-14-12-27(13-15-28)39-31(41)29(22-30(40)35-25-8-4-23(33)5-9-25)38(32(39)43)17-3-16-36-18-20-37(21-19-36)26-10-6-24(34)7-11-26/h4-15,29H,2-3,16-22H2,1H3,(H,35,40)/t29-/m0/s1

InChI Key

GHAJHBUSVJQQDE-LJAQVGFWSA-N

MDL Number (MFCD)

MFCD14722714

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

624.18

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.777

Distribution Coefficient, logD

4.550

Water Solubility, LogSw

-4.71

Polar Surface Area

55.742

Acid Dissociation Constant (pKa)

10.39

Base Dissociation Constant (pKb)

7.24

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.40

C148-0656 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C148-0656 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C148-0656?
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What is the minimum amount of C148-0656 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C148-0656
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C148-0656
  • 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 C148-0656 available by request