C699-1728 Screening compound: N-[(2-chlorophenyl)methyl]-4-ethyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

C699-1728 Screening compound: N-[(2-chlorophenyl)methyl]-4-ethyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
C699-1728 Screening compound: N-[(2-chlorophenyl)methyl]-4-ethyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C699-1728
N-[(2-chlorophenyl)methyl]-4-ethyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

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

C699-1728

Molecular Formula

C18H19ClN2OS (C18 H19 ClN2 OS)

Compound Name

N-[(2-chlorophenyl)methyl]-4-ethyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

IUPAC name

N-[(2-chlorophenyl)methyl]-4-ethyl-34-dihydro-2H-14-benzothiazine-6-carboxamide

SMILES

CCN1c(cc(cc2)C(NCc(cccc3)c3Cl)=O)c2SCC1

InChI

InChI=1S/C18H19ClN2OS/c1-2-21-9-10-23-17-8-7-13(11-16(17)21)18(22)20-12-14-5-3-4-6-15(14)19/h3-8,11H,2,9-10,12H2,1H3,(H,20,22)

InChI Key

PSFWSLXJCRBSFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14784404

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.88

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.061

Distribution Coefficient, logD

4.061

Water Solubility, LogSw

-4.37

Polar Surface Area

27.211

Acid Dissociation Constant (pKa)

13.34

Base Dissociation Constant (pKb)

7.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

C699-1728 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anticancer Library (62698 compounds)

Cardiovascular Library (22201 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Cardiovascular
  • Cancer
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Others

References: we are preparing a list of scientific research reports with C699-1728 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C699-1728?
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What is the minimum amount of C699-1728 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C699-1728
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C699-1728
  • 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 C699-1728 available by request