M444-0010 Screening compound: N-(3,5-DIMETHYLPHENYL)-2-[4-OXO-2-(PIPERIDIN-1-YL)-3H,4H-THIENO[3,2-D]PYRIMIDIN-3-YL]ACETAMIDE

M444-0010 Screening compound: N-(3,5-DIMETHYLPHENYL)-2-[4-OXO-2-(PIPERIDIN-1-YL)-3H,4H-THIENO[3,2-D]PYRIMIDIN-3-YL]ACETAMIDE
M444-0010 Screening compound: N-(3,5-DIMETHYLPHENYL)-2-[4-OXO-2-(PIPERIDIN-1-YL)-3H,4H-THIENO[3,2-D]PYRIMIDIN-3-YL]ACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound M444-0010
N-(3,5-DIMETHYLPHENYL)-2-[4-OXO-2-(PIPERIDIN-1-YL)-3H,4H-THIENO[3,2-D]PYRIMIDIN-3-YL]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

M444-0010

Molecular Formula

C21H24N4O2S (C21 H24 N4 O2 S)

Compound Name

N-(3,5-DIMETHYLPHENYL)-2-[4-OXO-2-(PIPERIDIN-1-YL)-3H,4H-THIENO[3,2-D]PYRIMIDIN-3-YL]ACETAMIDE

IUPAC name

n/a

SMILES

Cc1cc(NC(CN(C2=O)C(N3CCCCC3)=Nc3c2scc3)=O)cc(C)c1

InChI

InChI=1S/C21H24N4O2S/c1-14-10-15(2)12-16(11-14)22-18(26)13-25-20(27)19-17(6-9-28-19)23-21(25)24-7-4-3-5-8-24/h6,9-12H,3-5,7-8,13H2,1-2H3,(H,22,26)

InChI Key

OCZSGMVZVWFWDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15141666

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.891

Distribution Coefficient, logD

3.891

Water Solubility, LogSw

-3.86

Polar Surface Area

52.990

Acid Dissociation Constant (pKa)

13.34

Base Dissociation Constant (pKb)

3.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

M444-0010 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with M444-0010 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M444-0010?
Check Price and Availability of M444-0010, 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 M444-0010 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M444-0010
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M444-0010
  • 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 M444-0010 available by request