Screening compound: C31H32N2O3S (C380-0772)

Screening compound: C<sub>31</sub>H<sub>32</sub>N<sub>2</sub>O<sub>3</sub>S (C380-0772)
Screening compound: C<sub>31</sub>H<sub>32</sub>N<sub>2</sub>O<sub>3</sub>S (C380-0772) alternative view

Chemical Structure Depiction of ChemDiv screening compound
C31H32N2O3S (C380-0772)

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

C380-0772

Molecular Formula

C31H32N2O3S (C31 H32 N2 O3 S)

Compound Name

N~8~-[2-(1-cyclohexenyl)ethyl]-10-(4-ethoxybenzyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-9-[(4-ethoxyphenyl)methyl]-10-oxo-2-thia-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)461214-hexaene-6-carboxamide

SMILES

CCOc1ccc(CN(c(cc(cc2)C(NCCC3=CCCCC3)=O)c2Sc2c3cccc2)C3=O)cc1

InChI

InChI=1S/C31H32N2O3S/c1-2-36-25-15-12-23(13-16-25)21-33-27-20-24(30(34)32-19-18-22-8-4-3-5-9-22)14-17-29(27)37-28-11-7-6-10-26(28)31(33)35/h6-8,10-17,20H,2-5,9,18-19,21H2,1H3,(H,32,34)

InChI Key

DBUIVPNKKPQGDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14754803

C31H32N2O3S (C380-0772) in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein-Protein Interaction Library (218420 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with C31H32N2O3S (C380-0772) chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C31H32N2O3S (C380-0772)?
Check Price and Availability of C31H32N2O3S (C380-0772), then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C31H32N2O3S (C380-0772) you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C31H32N2O3S (C380-0772)
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C31H32N2O3S (C380-0772)
  • 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 C31H32N2O3S (C380-0772) available by request