M422-0199 Screening compound: 4-acetamido-N-{[4-(methylsulfanyl)phenyl]methyl}-3-(pyridin-2-yl)-1,2-thiazole-5-carboxamide

M422-0199 Screening compound: 4-acetamido-N-{[4-(methylsulfanyl)phenyl]methyl}-3-(pyridin-2-yl)-1,2-thiazole-5-carboxamide
M422-0199 Screening compound: 4-acetamido-N-{[4-(methylsulfanyl)phenyl]methyl}-3-(pyridin-2-yl)-1,2-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M422-0199
4-acetamido-N-{[4-(methylsulfanyl)phenyl]methyl}-3-(pyridin-2-yl)-1,2-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

M422-0199

Molecular Formula

C19H18N4O2S2 (C19 H18 N4 O2 S2)

Compound Name

4-acetamido-N-{[4-(methylsulfanyl)phenyl]methyl}-3-(pyridin-2-yl)-1,2-thiazole-5-carboxamide

IUPAC name

4-acetamido-N-{[4-(methylsulfanyl)phenyl]methyl}-3-(pyridin-2-yl)-12-thiazole-5-carboxamide

SMILES

CC(Nc1c(C(NCc(cc2)ccc2SC)=O)snc1-c1ncccc1)=O

InChI

InChI=1S/C19H18N4O2S2/c1-12(24)22-17-16(15-5-3-4-10-20-15)23-27-18(17)19(25)21-11-13-6-8-14(26-2)9-7-13/h3-10H,11H2,1-2H3,(H,21,25)(H,22,24)

InChI Key

AUVFGTCCGBTRLB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27540865

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.005

Distribution Coefficient, logD

2.004

Water Solubility, LogSw

-2.41

Polar Surface Area

66.556

Acid Dissociation Constant (pKa)

10.04

Base Dissociation Constant (pKb)

3.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

M422-0199 in Drug Discovery

Included in Screening Libraries

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

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with M422-0199 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M422-0199?
Check Price and Availability of M422-0199, 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 M422-0199 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M422-0199
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M422-0199
  • 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 M422-0199 available by request