G549-0401 Screening compound: N-methyl-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]-N-phenylacetamide

G549-0401 Screening compound: N-methyl-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]-N-phenylacetamide
G549-0401 Screening compound: N-methyl-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G549-0401
N-methyl-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]-N-phenylacetamide

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

G549-0401

Molecular Formula

C21H23N3O5S2 (C21 H23 N3 O5 S2)

Compound Name

N-methyl-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]-N-phenylacetamide

IUPAC name

N-methyl-2-[6-(morpholine-4-sulfonyl)-3-oxo-34-dihydro-2H-14-benzothiazin-4-yl]-N-phenylacetamide

SMILES

CN(C(CN1c(cc(cc2)S(N3CCOCC3)(=O)=O)c2SCC1=O)=O)c1ccccc1

InChI

InChI=1S/C21H23N3O5S2/c1-22(16-5-3-2-4-6-16)20(25)14-24-18-13-17(7-8-19(18)30-15-21(24)26)31(27,28)23-9-11-29-12-10-23/h2-8,13H,9-12,14-15H2,1H3

InChI Key

MWFOBWXQUJZZCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15019117

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.56

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.384

Distribution Coefficient, logD

1.384

Water Solubility, LogSw

-2.45

Polar Surface Area

70.352

Acid Dissociation Constant (pKa)

20.50

Base Dissociation Constant (pKb)

-0.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

G549-0401 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 G549-0401 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G549-0401?
Check Price and Availability of G549-0401, 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 G549-0401 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G549-0401
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G549-0401
  • 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 G549-0401 available by request