8019-4633 Screening compound: 4-(3,4-dihydro-2H-1-benzopyran-6-yl)-1,3-thiazol-2-amine

8019-4633 Screening compound: 4-(3,4-dihydro-2H-1-benzopyran-6-yl)-1,3-thiazol-2-amine
8019-4633 Screening compound: 4-(3,4-dihydro-2H-1-benzopyran-6-yl)-1,3-thiazol-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-4633
4-(3,4-dihydro-2H-1-benzopyran-6-yl)-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

8019-4633

Molecular Formula

C12H12N2OS (C12 H12 N2 OS)

Compound Name

4-(3,4-dihydro-2H-1-benzopyran-6-yl)-1,3-thiazol-2-amine

IUPAC name

4-(34-dihydro-2H-1-benzopyran-6-yl)-13-thiazol-2-amine

SMILES

Nc1nc(-c(cc2)cc3c2OCCC3)cs1

InChI

InChI=1S/C12H12N2OS/c13-12-14-10(7-16-12)8-3-4-11-9(6-8)2-1-5-15-11/h3-4,6-7H,1-2,5H2,(H2,13,14)

InChI Key

MQHCIGCWEBUGQS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08146592

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

232.31

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.044

Distribution Coefficient, logD

3.044

Water Solubility, LogSw

-3.23

Polar Surface Area

38.642

Acid Dissociation Constant (pKa)

21.44

Base Dissociation Constant (pKb)

3.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

8019-4633 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

Antiparasite Library (23996 compounds)

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

CORONAVIRUS Library (20774 compounds)

Fragments Library (11262 compounds)

GABA Library (7115 compounds)

Soluble Diversity Library (15920 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Eye
  • Nervous system
  • Cardiovascular
Agro:
  • Agro
Structure:
  • Fragments
Targets:
  • GPCR
  • Ion Channels
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8019-4633 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-4633?
Check Price and Availability of 8019-4633, 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 8019-4633 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-4633
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-4633
  • 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 8019-4633 available by request