8018-8982 Screening compound: N-(2-chlorobenzyl)-N-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amine

8018-8982 Screening compound: N-(2-chlorobenzyl)-N-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amine
8018-8982 Screening compound: N-(2-chlorobenzyl)-N-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8982
N-(2-chlorobenzyl)-N-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)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

8018-8982

Molecular Formula

C11H13ClN2S (C11 H13 ClN2 S)

Compound Name

N-(2-chlorobenzyl)-N-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amine

IUPAC name

N-[(2-chlorophenyl)methyl]-5-methyl-45-dihydro-13-thiazol-2-amine

SMILES

CC1SC(NCc(cccc2)c2Cl)=NC1

InChI

InChI=1S/C11H13ClN2S/c1-8-6-13-11(15-8)14-7-9-4-2-3-5-10(9)12/h2-5,8H,6-7H2,1H3,(H,13,14)/t8-/m1/s1

InChI Key

MOAMXBNMZAYBBS-MRVPVSSYSA-N

MDL Number (MFCD)

MFCD01655181

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

240.76

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.346

Distribution Coefficient, logD

2.486

Water Solubility, LogSw

-3.52

Polar Surface Area

19.851

Acid Dissociation Constant (pKa)

15.40

Base Dissociation Constant (pKb)

8.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.36

8018-8982 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiparasite Library (23996 compounds)

CNS BBB Library (22607 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Ion Channels Focused Library (26372 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Nervous system
  • Cardiovascular
Agro:
  • Agro
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 8018-8982 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8982?
Check Price and Availability of 8018-8982, 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 8018-8982 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8982
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8982
  • 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 8018-8982 available by request