6266-2031 Screening compound: N-(4-chlorophenyl)-2-(3-{[(4E)-1-ethyl-2,5-dioxoimidazolidin-4-ylidene]methyl}-1H-indol-1-yl)acetamide

6266-2031 Screening compound: N-(4-chlorophenyl)-2-(3-{[(4E)-1-ethyl-2,5-dioxoimidazolidin-4-ylidene]methyl}-1H-indol-1-yl)acetamide
6266-2031 Screening compound: N-(4-chlorophenyl)-2-(3-{[(4E)-1-ethyl-2,5-dioxoimidazolidin-4-ylidene]methyl}-1H-indol-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6266-2031
N-(4-chlorophenyl)-2-(3-{[(4E)-1-ethyl-2,5-dioxoimidazolidin-4-ylidene]methyl}-1H-indol-1-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

6266-2031

Molecular Formula

C22H19ClN4O3 (C22 H19 ClN4 O3)

Compound Name

N-(4-chlorophenyl)-2-(3-{[(4E)-1-ethyl-2,5-dioxoimidazolidin-4-ylidene]methyl}-1H-indol-1-yl)acetamide

IUPAC name

N-(4-chlorophenyl)-2-(3-{[(4E)-1-ethyl-25-dioxoimidazolidin-4-ylidene]methyl}-1H-indol-1-yl)acetamide

SMILES

CCN(C(/C(/N1)=C\c2cn(CC(Nc(cc3)ccc3Cl)=O)c3c2cccc3)=O)C1=O

InChI

InChI=1S/C22H19ClN4O3/c1-2-27-21(29)18(25-22(27)30)11-14-12-26(19-6-4-3-5-17(14)19)13-20(28)24-16-9-7-15(23)8-10-16/h3-12H,2,13H2,1H3,(H,24,28)(H,25,30)

InChI Key

MXLSHZXCTYZXHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04276604

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.818

Distribution Coefficient, logD

3.818

Water Solubility, LogSw

-4.28

Polar Surface Area

65.548

Acid Dissociation Constant (pKa)

10.58

Base Dissociation Constant (pKb)

-5.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

6266-2031 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6266-2031 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6266-2031?
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What is the minimum amount of 6266-2031 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6266-2031
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6266-2031
  • 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 6266-2031 available by request