C593-1386 Screening compound: N-[3-(3-chlorophenyl)-1,2-oxazol-5-yl]-8-methyl-4-oxo-4H-thieno[3,2-c]chromene-2-carboxamide

C593-1386 Screening compound: N-[3-(3-chlorophenyl)-1,2-oxazol-5-yl]-8-methyl-4-oxo-4H-thieno[3,2-c]chromene-2-carboxamide
C593-1386 Screening compound: N-[3-(3-chlorophenyl)-1,2-oxazol-5-yl]-8-methyl-4-oxo-4H-thieno[3,2-c]chromene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C593-1386
N-[3-(3-chlorophenyl)-1,2-oxazol-5-yl]-8-methyl-4-oxo-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

C593-1386

Molecular Formula

C22H13ClN2O4S (C22 H13 ClN2 O4 S)

Compound Name

N-[3-(3-chlorophenyl)-1,2-oxazol-5-yl]-8-methyl-4-oxo-4H-thieno[3,2-c]chromene-2-carboxamide

IUPAC name

N-[3-(3-chlorophenyl)-12-oxazol-5-yl]-8-methyl-4-oxo-4H-thieno[32-c]chromene-2-carboxamide

SMILES

Cc(cc1)cc(-c2c3cc(C(Nc4cc(-c5cccc(Cl)c5)no4)=O)s2)c1OC3=O

InChI

InChI=1S/C22H13ClN2O4S/c1-11-5-6-17-14(7-11)20-15(22(27)28-17)9-18(30-20)21(26)24-19-10-16(25-29-19)12-3-2-4-13(23)8-12/h2-10H,1H3,(H,24,26)

InChI Key

WGXKVEJWMMZIRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14774163

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.88

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.005

Distribution Coefficient, logD

6.004

Water Solubility, LogSw

-6.03

Polar Surface Area

67.279

Acid Dissociation Constant (pKa)

10.23

Base Dissociation Constant (pKb)

-8.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

C593-1386 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C593-1386 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C593-1386?
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What is the minimum amount of C593-1386 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C593-1386
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C593-1386
  • 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 C593-1386 available by request