G943-0157 Screening compound: N~3~-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-oxo-2H-chromene-3-carboxamide

G943-0157 Screening compound: N~3~-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-oxo-2H-chromene-3-carboxamide
G943-0157 Screening compound: N~3~-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-oxo-2H-chromene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G943-0157
N~3~-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-oxo-2H-chromene-3-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

G943-0157

Molecular Formula

C25H18N2O4S (C25 H18 N2 O4 S)

Compound Name

N~3~-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-oxo-2H-chromene-3-carboxamide

IUPAC name

N-{9-ethyl-10-oxo-2-thia-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3571214-hexaen-5-yl}-2-oxo-2H-chromene-3-carboxamide

SMILES

CCN(c(ccc(NC(C1=Cc(cccc2)c2OC1=O)=O)c1)c1Sc1c2cccc1)C2=O

InChI

InChI=1S/C25H18N2O4S/c1-2-27-19-12-11-16(14-22(19)32-21-10-6-4-8-17(21)24(27)29)26-23(28)18-13-15-7-3-5-9-20(15)31-25(18)30/h3-14H,2H2,1H3,(H,26,28)

InChI Key

JWUQEKRWFYNSCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15076602

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.824

Distribution Coefficient, logD

4.824

Water Solubility, LogSw

-4.51

Polar Surface Area

59.410

Acid Dissociation Constant (pKa)

10.54

Base Dissociation Constant (pKb)

-2.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

G943-0157 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G943-0157 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G943-0157?
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What is the minimum amount of G943-0157 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G943-0157
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G943-0157
  • 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 G943-0157 available by request