M371-0547 Screening compound: 8-{2-METHYL-3-[(MORPHOLIN-4-YL)METHYL]-4H-THIENO[3,2-B]PYRROLE-5-CARBONYL}-1,4-DIOXA-8-AZASPIRO[4.5]DECANE

M371-0547 Screening compound: 8-{2-METHYL-3-[(MORPHOLIN-4-YL)METHYL]-4H-THIENO[3,2-B]PYRROLE-5-CARBONYL}-1,4-DIOXA-8-AZASPIRO[4.5]DECANE
M371-0547 Screening compound: 8-{2-METHYL-3-[(MORPHOLIN-4-YL)METHYL]-4H-THIENO[3,2-B]PYRROLE-5-CARBONYL}-1,4-DIOXA-8-AZASPIRO[4.5]DECANE alternative view

Chemical Structure Depiction of ChemDiv screening compound M371-0547
8-{2-METHYL-3-[(MORPHOLIN-4-YL)METHYL]-4H-THIENO[3,2-B]PYRROLE-5-CARBONYL}-1,4-DIOXA-8-AZASPIRO[4.5]DECANE

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

M371-0547

Molecular Formula

C20H27N3O4S (C20 H27 N3 O4 S)

Compound Name

8-{2-METHYL-3-[(MORPHOLIN-4-YL)METHYL]-4H-THIENO[3,2-B]PYRROLE-5-CARBONYL}-1,4-DIOXA-8-AZASPIRO[4.5]DECANE

IUPAC name

n/a

SMILES

Cc1c(CN2CCOCC2)c([nH]c(C(N(CC2)CCC22OCCO2)=O)c2)c2s1

InChI

InChI=1S/C20H27N3O4S/c1-14-15(13-22-6-8-25-9-7-22)18-17(28-14)12-16(21-18)19(24)23-4-2-20(3-5-23)26-10-11-27-20/h12,21H,2-11,13H2,1H3

InChI Key

BGOXVPCXGVWFJC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27538918

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.522

Distribution Coefficient, logD

1.468

Water Solubility, LogSw

-2.33

Polar Surface Area

54.103

Acid Dissociation Constant (pKa)

13.80

Base Dissociation Constant (pKb)

6.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.00

M371-0547 in Drug Discovery

Included in Screening Libraries

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

Eccentric PPI Library (11937 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with M371-0547 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M371-0547?
Check Price and Availability of M371-0547, 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 M371-0547 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M371-0547
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M371-0547
  • 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 M371-0547 available by request