2742-2930 Screening compound: 2-{3-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-phenylacetamide

2742-2930 Screening compound: 2-{3-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-phenylacetamide
2742-2930 Screening compound: 2-{3-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2742-2930
2-{3-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-5-oxo-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

2742-2930

Molecular Formula

C22H25N3O4S (C22 H25 N3 O4 S)

Compound Name

2-{3-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-phenylacetamide

IUPAC name

2-{3-[2-(34-dimethoxyphenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-phenylacetamide

SMILES

CN(C(C(CC(Nc1ccccc1)=O)N1CCc(cc2)cc(OC)c2OC)=O)C1=S

InChI

InChI=1S/C22H25N3O4S/c1-24-21(27)17(14-20(26)23-16-7-5-4-6-8-16)25(22(24)30)12-11-15-9-10-18(28-2)19(13-15)29-3/h4-10,13,17H,11-12,14H2,1-3H3,(H,23,26)/t17-/m1/s1

InChI Key

RIQYAJCBJHCCHJ-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD02142663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.978

Distribution Coefficient, logD

1.978

Water Solubility, LogSw

-2.84

Polar Surface Area

57.285

Acid Dissociation Constant (pKa)

12.18

Base Dissociation Constant (pKb)

2.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

2742-2930 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 2742-2930 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2742-2930?
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What is the minimum amount of 2742-2930 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2742-2930
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2742-2930
  • 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 2742-2930 available by request