8018-8932 Screening compound: N-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)-N-(1-phenylethyl)amine

8018-8932 Screening compound: N-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)-N-(1-phenylethyl)amine
8018-8932 Screening compound: N-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)-N-(1-phenylethyl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8932
N-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)-N-(1-phenylethyl)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

8018-8932

Molecular Formula

C12H16N2S (C12 H16 N2 S)

Compound Name

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

IUPAC name

5-methyl-N-(1-phenylethyl)-45-dihydro-13-thiazol-2-amine

SMILES

CC(c1ccccc1)NC1=NCC(C)S1

InChI

InChI=1S/C12H16N2S/c1-9-8-13-12(15-9)14-10(2)11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,13,14)

InChI Key

ZJIQMPFFCHYYLL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00852646

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

220.34

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

3.059

Distribution Coefficient, logD

2.078

Water Solubility, LogSw

-3.12

Polar Surface Area

19.014

Acid Dissociation Constant (pKa)

15.37

Base Dissociation Constant (pKb)

8.33

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

41.67

8018-8932 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS Targets (44014 compounds)

Dark Chemical Matter Library (18430 compounds)

Ion Channels Focused Library (26372 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 8018-8932 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8932?
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What is the minimum amount of 8018-8932 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8932
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8932
  • 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 8018-8932 available by request