C862-1624 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}acetamide

C862-1624 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}acetamide
C862-1624 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C862-1624
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}acetamide

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

C862-1624

Molecular Formula

C19H25N3O2S (C19 H25 N3 O2 S)

Compound Name

N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}acetamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{68-dimethyl-2-oxo-1H2H3H-pyrido[23-b][14]thiazin-1-yl}acetamide

SMILES

Cc(cc(C)nc1SC2)c1N(CC(NCCC1=CCCCC1)=O)C2=O

InChI

InChI=1S/C19H25N3O2S/c1-13-10-14(2)21-19-18(13)22(17(24)12-25-19)11-16(23)20-9-8-15-6-4-3-5-7-15/h6,10H,3-5,7-9,11-12H2,1-2H3,(H,20,23)

InChI Key

WYKBPTOWQYEEIX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14801930

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.701

Distribution Coefficient, logD

2.696

Water Solubility, LogSw

-2.99

Polar Surface Area

51.708

Acid Dissociation Constant (pKa)

15.01

Base Dissociation Constant (pKb)

5.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.60

C862-1624 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

3D-Diversity Natural-Product-Like Library (18102 compounds)

Antiviral Annotated Library (21441 compounds)

CNS MPO Library (28609 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • 3D
  • Pool
Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C862-1624 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C862-1624?
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What is the minimum amount of C862-1624 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C862-1624
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C862-1624
  • 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 C862-1624 available by request