6214-0769 Screening compound: N1-(1

6214-0769 Screening compound: N1-(1
6214-0769 Screening compound: N1-(1 alternative view

Chemical Structure Depiction of ChemDiv screening compound 6214-0769
N1-(1

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

6214-0769

Molecular Formula

C20H25NO4S2 (C20 H25 NO4 S2)

Compound Name

N1-(1

IUPAC name

n/a

SMILES

Cc(cc1C)cc(C)c1OCC(N(Cc1cccs1)C(CC1)CS1(=O)=O)=O

InChI

InChI=1S/C20H25NO4S2/c1-14-9-15(2)20(16(3)10-14)25-12-19(22)21(11-18-5-4-7-26-18)17-6-8-27(23,24)13-17/h4-5,7,9-10,17H,6,8,11-13H2,1-3H3/t17-/m1/s1

InChI Key

HHWXDFLUAABZCP-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD04021332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.278

Distribution Coefficient, logD

3.278

Water Solubility, LogSw

-3.26

Polar Surface Area

52.023

Acid Dissociation Constant (pKa)

20.41

Base Dissociation Constant (pKb)

-5.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

11.00

6214-0769 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 6214-0769 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6214-0769?
Check Price and Availability of 6214-0769, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6214-0769 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6214-0769
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6214-0769
  • 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 6214-0769 available by request