C148-0737 Screening compound: 2-[1-(4-methoxyphenyl)-5-oxo-3-[(pyridin-2-yl)methyl]-2-sulfanylideneimidazolidin-4-yl]-N-phenylacetamide

C148-0737 Screening compound: 2-[1-(4-methoxyphenyl)-5-oxo-3-[(pyridin-2-yl)methyl]-2-sulfanylideneimidazolidin-4-yl]-N-phenylacetamide
C148-0737 Screening compound: 2-[1-(4-methoxyphenyl)-5-oxo-3-[(pyridin-2-yl)methyl]-2-sulfanylideneimidazolidin-4-yl]-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C148-0737
2-[1-(4-methoxyphenyl)-5-oxo-3-[(pyridin-2-yl)methyl]-2-sulfanylideneimidazolidin-4-yl]-N-phenylacetamide

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

C148-0737

Molecular Formula

C24H22N4O3S (C24 H22 N4 O3 S)

Compound Name

2-[1-(4-methoxyphenyl)-5-oxo-3-[(pyridin-2-yl)methyl]-2-sulfanylideneimidazolidin-4-yl]-N-phenylacetamide

IUPAC name

2-[1-(4-methoxyphenyl)-5-oxo-3-[(pyridin-2-yl)methyl]-2-sulfanylideneimidazolidin-4-yl]-N-phenylacetamide

SMILES

COc(cc1)ccc1N(C(C(CC(Nc1ccccc1)=O)N1Cc2ncccc2)=O)C1=S

InChI

InChI=1S/C24H22N4O3S/c1-31-20-12-10-19(11-13-20)28-23(30)21(15-22(29)26-17-7-3-2-4-8-17)27(24(28)32)16-18-9-5-6-14-25-18/h2-14,21H,15-16H2,1H3,(H,26,29)/t21-/m1/s1

InChI Key

FXLLGOWOOJQUAU-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD05854344

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.366

Distribution Coefficient, logD

2.366

Water Solubility, LogSw

-2.85

Polar Surface Area

58.484

Acid Dissociation Constant (pKa)

12.18

Base Dissociation Constant (pKb)

2.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

C148-0737 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C148-0737 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C148-0737?
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What is the minimum amount of C148-0737 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C148-0737
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C148-0737
  • 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 C148-0737 available by request