5267-1312 Screening compound: 9-oxo-N2,N7-bis(1-phenylethyl)-9H-fluorene-2,7-disulfonamide

5267-1312 Screening compound: 9-oxo-N2,N7-bis(1-phenylethyl)-9H-fluorene-2,7-disulfonamide
5267-1312 Screening compound: 9-oxo-N2,N7-bis(1-phenylethyl)-9H-fluorene-2,7-disulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5267-1312
9-oxo-N2,N7-bis(1-phenylethyl)-9H-fluorene-2,7-disulfonamide

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

5267-1312

Molecular Formula

C29H26N2O5S2 (C29 H26 N2 O5 S2)

Compound Name

9-oxo-N2,N7-bis(1-phenylethyl)-9H-fluorene-2,7-disulfonamide

IUPAC name

9-oxo-N2N7-bis(1-phenylethyl)-9H-fluorene-27-disulfonamide

SMILES

CC(c1ccccc1)NS(c(cc1)cc2c1-c(ccc(S(NC(C)c1ccccc1)(=O)=O)c1)c1C2=O)(=O)=O

InChI

InChI=1S/C29H26N2O5S2/c1-19(21-9-5-3-6-10-21)30-37(33,34)23-13-15-25-26-16-14-24(18-28(26)29(32)27(25)17-23)38(35,36)31-20(2)22-11-7-4-8-12-22/h3-20,30-31H,1-2H3

InChI Key

TXZNNPZWNKZMND-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01023644

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

546.67

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.454

Distribution Coefficient, logD

5.453

Water Solubility, LogSw

-5.51

Polar Surface Area

95.670

Acid Dissociation Constant (pKa)

10.17

Base Dissociation Constant (pKb)

-6.45

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

13.80

5267-1312 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

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

CORONAVIRUS Library (20774 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 5267-1312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5267-1312?
Check Price and Availability of 5267-1312, 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 5267-1312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5267-1312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5267-1312
  • 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 5267-1312 available by request