M109-0177 Screening compound: N-(butan-2-yl)-2-({7-oxo-3-phenyl-6-propyl-6H,7H-[1,2]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide

M109-0177 Screening compound: N-(butan-2-yl)-2-({7-oxo-3-phenyl-6-propyl-6H,7H-[1,2]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide
M109-0177 Screening compound: N-(butan-2-yl)-2-({7-oxo-3-phenyl-6-propyl-6H,7H-[1,2]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M109-0177
N-(butan-2-yl)-2-({7-oxo-3-phenyl-6-propyl-6H,7H-[1,2]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide

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

M109-0177

Molecular Formula

C20H24N4O2S2 (C20 H24 N4 O2 S2)

Compound Name

N-(butan-2-yl)-2-({7-oxo-3-phenyl-6-propyl-6H,7H-[1,2]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide

IUPAC name

N-(butan-2-yl)-2-({7-oxo-3-phenyl-6-propyl-6H7H-[12]thiazolo[45-d]pyrimidin-5-yl}sulfanyl)acetamide

SMILES

CCCN(C1=O)C(SCC(NC(C)CC)=O)=Nc2c1snc2-c1ccccc1

InChI

InChI=1S/C20H24N4O2S2/c1-4-11-24-19(26)18-17(16(23-28-18)14-9-7-6-8-10-14)22-20(24)27-12-15(25)21-13(3)5-2/h6-10,13H,4-5,11-12H2,1-3H3,(H,21,25)/t13-/m0/s1

InChI Key

MMTFKWIHAFPQPA-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD27497318

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.664

Distribution Coefficient, logD

3.664

Water Solubility, LogSw

-3.76

Polar Surface Area

58.944

Acid Dissociation Constant (pKa)

16.24

Base Dissociation Constant (pKb)

6.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

M109-0177 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Angiogenesis library (14822 compounds)

Cysteine Proteases Inhibitors Library (7839 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with M109-0177 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M109-0177?
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What is the minimum amount of M109-0177 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M109-0177
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M109-0177
  • 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 M109-0177 available by request