M830-0821 Screening compound: 2-anilino-4-methyl-N-[2-(2-pyridyl)ethyl]-1,3-thiazole-5-carboxamide

M830-0821 Screening compound: 2-anilino-4-methyl-N-[2-(2-pyridyl)ethyl]-1,3-thiazole-5-carboxamide
M830-0821 Screening compound: 2-anilino-4-methyl-N-[2-(2-pyridyl)ethyl]-1,3-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M830-0821
2-anilino-4-methyl-N-[2-(2-pyridyl)ethyl]-1,3-thiazole-5-carboxamide

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

M830-0821

Molecular Formula

C18H18N4OS (C18 H18 N4 OS)

Compound Name

2-anilino-4-methyl-N-[2-(2-pyridyl)ethyl]-1,3-thiazole-5-carboxamide

IUPAC name

4-methyl-2-(phenylamino)-N-[2-(pyridin-2-yl)ethyl]-13-thiazole-5-carboxamide

SMILES

Cc1c(C(NCCc2ncccc2)=O)sc(Nc2ccccc2)n1

InChI

InChI=1S/C18H18N4OS/c1-13-16(17(23)20-12-10-14-7-5-6-11-19-14)24-18(21-13)22-15-8-3-2-4-9-15/h2-9,11H,10,12H2,1H3,(H,20,23)(H,21,22)

InChI Key

LPPLCSJSCVFFJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27555129

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.161

Distribution Coefficient, logD

3.161

Water Solubility, LogSw

-3.47

Polar Surface Area

53.572

Acid Dissociation Constant (pKa)

12.86

Base Dissociation Constant (pKb)

4.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

M830-0821 in Drug Discovery

Included in Screening Libraries

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

Serine Proteases Inhibitors Library (32732 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • Proteases
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with M830-0821 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M830-0821?
Check Price and Availability of M830-0821, 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 M830-0821 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M830-0821
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M830-0821
  • 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 M830-0821 available by request