G240-0547 Screening compound: N-[(4-fluorophenyl)methyl]-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

G240-0547 Screening compound: N-[(4-fluorophenyl)methyl]-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
G240-0547 Screening compound: N-[(4-fluorophenyl)methyl]-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G240-0547
N-[(4-fluorophenyl)methyl]-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

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

G240-0547

Molecular Formula

C21H23FN2O5S (C21 H23 FN2 O5 S)

Compound Name

N-[(4-fluorophenyl)methyl]-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

IUPAC name

N-[(4-fluorophenyl)methyl]-2-(piperidine-1-carbonyl)-23-dihydro-14-benzodioxine-6-sulfonamide

SMILES

O=C(C1Oc(ccc(S(NCc(cc2)ccc2F)(=O)=O)c2)c2OC1)N1CCCCC1

InChI

InChI=1S/C21H23FN2O5S/c22-16-6-4-15(5-7-16)13-23-30(26,27)17-8-9-18-19(12-17)28-14-20(29-18)21(25)24-10-2-1-3-11-24/h4-9,12,20,23H,1-3,10-11,13-14H2/t20-/m1/s1

InChI Key

VZJBPILJWAWSOQ-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD14989427

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.661

Distribution Coefficient, logD

2.661

Water Solubility, LogSw

-3.16

Polar Surface Area

74.082

Acid Dissociation Constant (pKa)

11.11

Base Dissociation Constant (pKb)

-0.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with G240-0547 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G240-0547?
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What is the minimum amount of G240-0547 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G240-0547
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G240-0547
  • 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 G240-0547 available by request