G549-0358 Screening compound: 4-[(2-chloro-6-fluorophenyl)methyl]-6-(morpholine-4-sulfonyl)-3,4-dihydro-2H-1,4-benzothiazin-3-one

G549-0358 Screening compound: 4-[(2-chloro-6-fluorophenyl)methyl]-6-(morpholine-4-sulfonyl)-3,4-dihydro-2H-1,4-benzothiazin-3-one
G549-0358 Screening compound: 4-[(2-chloro-6-fluorophenyl)methyl]-6-(morpholine-4-sulfonyl)-3,4-dihydro-2H-1,4-benzothiazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G549-0358
4-[(2-chloro-6-fluorophenyl)methyl]-6-(morpholine-4-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

G549-0358

Molecular Formula

C19H18ClFN2O4S2 (C19 H18 ClFN2 O4 S2)

Compound Name

4-[(2-chloro-6-fluorophenyl)methyl]-6-(morpholine-4-sulfonyl)-3,4-dihydro-2H-1,4-benzothiazin-3-one

IUPAC name

4-[(2-chloro-6-fluorophenyl)methyl]-6-(morpholine-4-sulfonyl)-34-dihydro-2H-14-benzothiazin-3-one

SMILES

O=C1N(Cc(c(F)ccc2)c2Cl)c(cc(cc2)S(N3CCOCC3)(=O)=O)c2SC1

InChI

InChI=1S/C19H18ClFN2O4S2/c20-15-2-1-3-16(21)14(15)11-23-17-10-13(4-5-18(17)28-12-19(23)24)29(25,26)22-6-8-27-9-7-22/h1-5,10H,6-9,11-12H2

InChI Key

JBQYXRYYWJYNOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15019104

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.95

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.278

Distribution Coefficient, logD

3.278

Water Solubility, LogSw

-3.47

Polar Surface Area

55.238

Acid Dissociation Constant (pKa)

20.50

Base Dissociation Constant (pKb)

-5.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with G549-0358 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G549-0358?
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What is the minimum amount of G549-0358 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G549-0358
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G549-0358
  • 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 G549-0358 available by request