M151-0657 Screening compound: 5-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-3-(4-fluorophenyl)-N,N-dimethyl-3H-thieno[2,3-d]imidazol-2-amine

M151-0657 Screening compound: 5-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-3-(4-fluorophenyl)-N,N-dimethyl-3H-thieno[2,3-d]imidazol-2-amine
M151-0657 Screening compound: 5-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-3-(4-fluorophenyl)-N,N-dimethyl-3H-thieno[2,3-d]imidazol-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound M151-0657
5-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-3-(4-fluorophenyl)-N,N-dimethyl-3H-thieno[2,3-d]imidazol-2-amine

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

M151-0657

Molecular Formula

C21H23FN4O3S (C21 H23 FN4 O3 S)

Compound Name

5-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-3-(4-fluorophenyl)-N,N-dimethyl-3H-thieno[2,3-d]imidazol-2-amine

IUPAC name

5-{14-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-3-(4-fluorophenyl)-NN-dimethyl-3H-thieno[23-d]imidazol-2-amine

SMILES

CN(C)c(n1-c(cc2)ccc2F)nc2c1sc(C(N(CC1)CCC11OCCO1)=O)c2

InChI

InChI=1S/C21H23FN4O3S/c1-24(2)20-23-16-13-17(30-19(16)26(20)15-5-3-14(22)4-6-15)18(27)25-9-7-21(8-10-25)28-11-12-29-21/h3-6,13H,7-12H2,1-2H3

InChI Key

ROWRFXQOMGDMSF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27532743

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.135

Distribution Coefficient, logD

2.838

Water Solubility, LogSw

-3.26

Polar Surface Area

45.194

Acid Dissociation Constant (pKa)

26.15

Base Dissociation Constant (pKb)

7.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

M151-0657 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

SmartTM Library (51161 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Proteases
  • Others

References: we are preparing a list of scientific research reports with M151-0657 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M151-0657?
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What is the minimum amount of M151-0657 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M151-0657
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M151-0657
  • 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 M151-0657 available by request