M422-0015 Screening compound: 4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(pyridin-2-yl)-1,2-thiazole-5-carboxamide

M422-0015 Screening compound: 4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(pyridin-2-yl)-1,2-thiazole-5-carboxamide
M422-0015 Screening compound: 4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(pyridin-2-yl)-1,2-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M422-0015
4-amino-N-[(2H-1,3-benzodioxol-5-yl)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

M422-0015

Molecular Formula

C17H14N4O3S (C17 H14 N4 O3 S)

Compound Name

4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(pyridin-2-yl)-1,2-thiazole-5-carboxamide

IUPAC name

4-amino-N-[(2H-13-benzodioxol-5-yl)methyl]-3-(pyridin-2-yl)-12-thiazole-5-carboxamide

SMILES

Nc1c(C(NCc(cc2)cc3c2OCO3)=O)snc1-c1ncccc1

InChI

InChI=1S/C17H14N4O3S/c18-14-15(11-3-1-2-6-19-11)21-25-16(14)17(22)20-8-10-4-5-12-13(7-10)24-9-23-12/h1-7H,8-9,18H2,(H,20,22)

InChI Key

GRHQDHWHMYWEFQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27540788

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.215

Distribution Coefficient, logD

2.215

Water Solubility, LogSw

-2.81

Polar Surface Area

81.192

Acid Dissociation Constant (pKa)

14.71

Base Dissociation Constant (pKb)

4.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

M422-0015 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with M422-0015 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M422-0015?
Check Price and Availability of M422-0015, 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 M422-0015 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M422-0015
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M422-0015
  • 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 M422-0015 available by request