1682-9937 Screening compound: 5-[(4-methoxyphenyl)methyl]-1,3-thiazol-2-amine

1682-9937 Screening compound: 5-[(4-methoxyphenyl)methyl]-1,3-thiazol-2-amine
1682-9937 Screening compound: 5-[(4-methoxyphenyl)methyl]-1,3-thiazol-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-9937
5-[(4-methoxyphenyl)methyl]-1,3-thiazol-2-amine

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

1682-9937

Molecular Formula

C11H12N2OS (C11 H12 N2 OS)

Compound Name

5-[(4-methoxyphenyl)methyl]-1,3-thiazol-2-amine

IUPAC name

5-[(4-methoxyphenyl)methyl]-13-thiazol-2-amine

SMILES

COc1ccc(Cc2cnc(N)s2)cc1

InChI

InChI=1S/C11H12N2OS/c1-14-9-4-2-8(3-5-9)6-10-7-13-11(12)15-10/h2-5,7H,6H2,1H3,(H2,12,13)

InChI Key

MSYFQOUPMXMROC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00706169

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

220.3

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.338

Distribution Coefficient, logD

2.337

Water Solubility, LogSw

-2.40

Polar Surface Area

38.836

Acid Dissociation Constant (pKa)

19.52

Base Dissociation Constant (pKb)

4.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.18

1682-9937 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Frequent Hitters Library (7624 compounds)

Soluble Diversity Library (15920 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Structure:
  • Pool
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 1682-9937 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-9937?
Check Price and Availability of 1682-9937, 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 1682-9937 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-9937
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-9937
  • 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 1682-9937 available by request