C593-1179 Screening compound: N,8-dimethyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4H-thieno[3,2-c]chromene-2-carboxamide

C593-1179 Screening compound: N,8-dimethyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4H-thieno[3,2-c]chromene-2-carboxamide
C593-1179 Screening compound: N,8-dimethyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4H-thieno[3,2-c]chromene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C593-1179
N,8-dimethyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4H-thieno[3,2-c]chromene-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

C593-1179

Molecular Formula

C21H14F3NO3S (C21 H14 F3 NO3 S)

Compound Name

N,8-dimethyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4H-thieno[3,2-c]chromene-2-carboxamide

IUPAC name

N8-dimethyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4H-thieno[32-c]chromene-2-carboxamide

SMILES

Cc(cc1)cc(-c2c3cc(C(N(C)c4cc(C(F)(F)F)ccc4)=O)s2)c1OC3=O

InChI

InChI=1S/C21H14F3NO3S/c1-11-6-7-16-14(8-11)18-15(20(27)28-16)10-17(29-18)19(26)25(2)13-5-3-4-12(9-13)21(22,23)24/h3-10H,1-2H3

InChI Key

TWTPPDIKFOVRBV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14774006

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.446

Distribution Coefficient, logD

5.446

Water Solubility, LogSw

-5.60

Polar Surface Area

37.276

Acid Dissociation Constant (pKa)

28.86

Base Dissociation Constant (pKb)

-4.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

C593-1179 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C593-1179 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C593-1179?
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What is the minimum amount of C593-1179 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C593-1179
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C593-1179
  • 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 C593-1179 available by request