6214-0532 Screening compound: 2-(4-chloro-2-methylphenoxy)-N~1~-(3,4-dimethoxybenzyl)-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)acetamide

6214-0532 Screening compound: 2-(4-chloro-2-methylphenoxy)-N~1~-(3,4-dimethoxybenzyl)-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)acetamide
6214-0532 Screening compound: 2-(4-chloro-2-methylphenoxy)-N~1~-(3,4-dimethoxybenzyl)-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6214-0532
2-(4-chloro-2-methylphenoxy)-N~1~-(3,4-dimethoxybenzyl)-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-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

6214-0532

Molecular Formula

C22H26ClNO6S (C22 H26 ClNO6 S)

Compound Name

2-(4-chloro-2-methylphenoxy)-N~1~-(3,4-dimethoxybenzyl)-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)acetamide

IUPAC name

2-(4-chloro-2-methylphenoxy)-N-[(34-dimethoxyphenyl)methyl]-N-(11-dioxo-1lambda6-thiolan-3-yl)acetamide

SMILES

Cc(cc(cc1)Cl)c1OCC(N(Cc(cc1)cc(OC)c1OC)C(CC1)CS1(=O)=O)=O

InChI

InChI=1S/C22H26ClNO6S/c1-15-10-17(23)5-7-19(15)30-13-22(25)24(18-8-9-31(26,27)14-18)12-16-4-6-20(28-2)21(11-16)29-3/h4-7,10-11,18H,8-9,12-14H2,1-3H3/t18-/m0/s1

InChI Key

SEOUBVPKIWTHFZ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD04030306

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.97

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.830

Distribution Coefficient, logD

2.830

Water Solubility, LogSw

-3.21

Polar Surface Area

66.179

Acid Dissociation Constant (pKa)

20.41

Base Dissociation Constant (pKb)

-4.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

6214-0532 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Lipid Metabolism Library (9174 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 6214-0532 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6214-0532?
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What is the minimum amount of 6214-0532 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6214-0532
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6214-0532
  • 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 6214-0532 available by request