Screening compound: C31H36ClN3O3S (K788-8416)

Screening compound: C<sub>31</sub>H<sub>36</sub>ClN<sub>3</sub>O<sub>3</sub>S (K788-8416)
Screening compound: C<sub>31</sub>H<sub>36</sub>ClN<sub>3</sub>O<sub>3</sub>S (K788-8416) alternative view

Chemical Structure Depiction of ChemDiv screening compound
C31H36ClN3O3S (K788-8416)

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

K788-8416

Molecular Formula

C31H36ClN3O3S (C31 H36 ClN3 O3 S)

Compound Name

10-(3-chlorobenzyl)-N~8~-[2-(dibutylamino)ethyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide

IUPAC name

9-[(3-chlorophenyl)methyl]-N-[2-(dibutylamino)ethyl]-210-dioxo-2lambda4-thia-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(15)3(8)461113-hexaene-6-carboxamide

SMILES

CCCCN(CCCC)CCNC(c(cc1)cc(N(Cc2cccc(Cl)c2)C(c2c3cccc2)=O)c1S3=O)=O

InChI

InChI=1S/C31H38ClN3O3S/c1-3-5-17-34(18-6-4-2)19-16-33-30(36)24-14-15-29-27(21-24)35(22-23-10-9-11-25(32)20-23)31(37)26-12-7-8-13-28(26)39(29)38/h7-15,20-21H,3-6,16-19,22,39H2,1-2H3,(H,33,36)

InChI Key

XOSGFCQEGIUSAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15107767

C31H36ClN3O3S (K788-8416) in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Eccentric PPI Library (11937 compounds)

MCL1 Targeted Library (12200 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Mimetics

References: we are preparing a list of scientific research reports with C31H36ClN3O3S (K788-8416) chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C31H36ClN3O3S (K788-8416)?
Check Price and Availability of C31H36ClN3O3S (K788-8416), 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 C31H36ClN3O3S (K788-8416) you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C31H36ClN3O3S (K788-8416)
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C31H36ClN3O3S (K788-8416)
  • 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 C31H36ClN3O3S (K788-8416) available by request