K784-7961 Screening compound: 4-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopentyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

K784-7961 Screening compound: 4-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopentyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
K784-7961 Screening compound: 4-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopentyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-7961
4-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopentyl-3-oxo-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

K784-7961

Molecular Formula

C21H20ClFN2O2S (C21 H20 ClFN2 O2 S)

Compound Name

4-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopentyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

IUPAC name

4-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopentyl-3-oxo-34-dihydro-2H-14-benzothiazine-6-carboxamide

SMILES

O=C(c(cc1)cc(N2Cc(c(F)ccc3)c3Cl)c1SCC2=O)NC1CCCC1

InChI

InChI=1S/C21H20ClFN2O2S/c22-16-6-3-7-17(23)15(16)11-25-18-10-13(8-9-19(18)28-12-20(25)26)21(27)24-14-4-1-2-5-14/h3,6-10,14H,1-2,4-5,11-12H2,(H,24,27)

InChI Key

ZRJOEPJPKQNYHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04063520

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.92

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.322

Distribution Coefficient, logD

4.322

Water Solubility, LogSw

-4.54

Polar Surface Area

40.123

Acid Dissociation Constant (pKa)

15.62

Base Dissociation Constant (pKb)

-1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

References: we are preparing a list of scientific research reports with K784-7961 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-7961?
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What is the minimum amount of K784-7961 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-7961
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-7961
  • 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 K784-7961 available by request