G943-0792 Screening compound: N~3~-(10-isopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-5-oxo-1-phenyl-3-pyrrolidinecarboxamide

G943-0792 Screening compound: N~3~-(10-isopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-5-oxo-1-phenyl-3-pyrrolidinecarboxamide
G943-0792 Screening compound: N~3~-(10-isopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-5-oxo-1-phenyl-3-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G943-0792
N~3~-(10-isopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-5-oxo-1-phenyl-3-pyrrolidinecarboxamide

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

G943-0792

Molecular Formula

C27H25N3O3S (C27 H25 N3 O3 S)

Compound Name

N~3~-(10-isopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-5-oxo-1-phenyl-3-pyrrolidinecarboxamide

IUPAC name

5-oxo-N-[10-oxo-9-(propan-2-yl)-2-thia-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)461214-hexaen-5-yl]-1-phenylpyrrolidine-3-carboxamide

SMILES

CC(C)N(c(ccc(NC(C(CC1=O)CN1c1ccccc1)=O)c1)c1Sc1c2cccc1)C2=O

InChI

InChI=1S/C27H25N3O3S/c1-17(2)30-22-13-12-19(15-24(22)34-23-11-7-6-10-21(23)27(30)33)28-26(32)18-14-25(31)29(16-18)20-8-4-3-5-9-20/h3-13,15,17-18H,14,16H2,1-2H3,(H,28,32)/t18-/m0/s1

InChI Key

JBKDIQQNOFPPMA-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27169063

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.329

Distribution Coefficient, logD

4.329

Water Solubility, LogSw

-4.27

Polar Surface Area

55.234

Acid Dissociation Constant (pKa)

12.03

Base Dissociation Constant (pKb)

-2.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

G943-0792 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiviral Library (67538 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G943-0792 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G943-0792?
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What is the minimum amount of G943-0792 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G943-0792
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G943-0792
  • 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 G943-0792 available by request