E465-0576 Screening compound: 2-methyl-6-[(2-methylpiperidin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzothiazin-3-one

E465-0576 Screening compound: 2-methyl-6-[(2-methylpiperidin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzothiazin-3-one
E465-0576 Screening compound: 2-methyl-6-[(2-methylpiperidin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzothiazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E465-0576
2-methyl-6-[(2-methylpiperidin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzothiazin-3-one

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

E465-0576

Molecular Formula

C15H20N2O3S2 (C15 H20 N2 O3 S2)

Compound Name

2-methyl-6-[(2-methylpiperidin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzothiazin-3-one

IUPAC name

2-methyl-6-[(2-methylpiperidin-1-yl)sulfonyl]-34-dihydro-2H-14-benzothiazin-3-one

SMILES

CC(CCCC1)N1S(c(cc1)cc(N2)c1SC(C)C2=O)(=O)=O

InChI

InChI=1S/C15H20N2O3S2/c1-10-5-3-4-8-17(10)22(19,20)12-6-7-14-13(9-12)16-15(18)11(2)21-14/h6-7,9-11H,3-5,8H2,1-2H3,(H,16,18)

InChI Key

LVHROHTWGGVDNR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14854457

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.733

Distribution Coefficient, logD

2.733

Water Solubility, LogSw

-3.43

Polar Surface Area

56.889

Acid Dissociation Constant (pKa)

11.79

Base Dissociation Constant (pKb)

-3.19

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

53.30

E465-0576 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with E465-0576 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E465-0576?
Check Price and Availability of E465-0576, 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 E465-0576 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E465-0576
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E465-0576
  • 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 E465-0576 available by request