C909-0364 Screening compound: N~2~-(4-fluorophenyl)-5,5-dioxo-N~2~-propyl-4,5-dihydro-5lambda~6~-thieno[3,2-c]thiochromene-2-carboxamide

C909-0364 Screening compound: N~2~-(4-fluorophenyl)-5,5-dioxo-N~2~-propyl-4,5-dihydro-5lambda~6~-thieno[3,2-c]thiochromene-2-carboxamide
C909-0364 Screening compound: N~2~-(4-fluorophenyl)-5,5-dioxo-N~2~-propyl-4,5-dihydro-5lambda~6~-thieno[3,2-c]thiochromene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C909-0364
N~2~-(4-fluorophenyl)-5,5-dioxo-N~2~-propyl-4,5-dihydro-5lambda~6~-thieno[3,2-c]thiochromene-2-carboxamide

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

C909-0364

Molecular Formula

C21H18FNO3S2 (C21 H18 FNO3 S2)

Compound Name

N~2~-(4-fluorophenyl)-5,5-dioxo-N~2~-propyl-4,5-dihydro-5lambda~6~-thieno[3,2-c]thiochromene-2-carboxamide

IUPAC name

N-(4-fluorophenyl)-55-dioxo-N-propyl-4H-5lambda6-thieno[32-c]thiochromene-2-carboxamide

SMILES

CCCN(C(c1cc(CS(c2c-3cccc2)(=O)=O)c3s1)=O)c(cc1)ccc1F

InChI

InChI=1S/C21H18FNO3S2/c1-2-11-23(16-9-7-15(22)8-10-16)21(24)18-12-14-13-28(25,26)19-6-4-3-5-17(19)20(14)27-18/h3-10,12H,2,11,13H2,1H3

InChI Key

NIQXJELTJOINOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14808108

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.788

Distribution Coefficient, logD

4.788

Water Solubility, LogSw

-4.54

Polar Surface Area

45.033

Acid Dissociation Constant (pKa)

19.14

Base Dissociation Constant (pKb)

-2.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

C909-0364 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C909-0364 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C909-0364?
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What is the minimum amount of C909-0364 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C909-0364
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C909-0364
  • 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 C909-0364 available by request