C481-1500 Screening compound: N-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-1-phenylethyl}-2,1,3-benzothiadiazole-4-sulfonamide

C481-1500 Screening compound: N-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-1-phenylethyl}-2,1,3-benzothiadiazole-4-sulfonamide
C481-1500 Screening compound: N-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-1-phenylethyl}-2,1,3-benzothiadiazole-4-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C481-1500
N-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-1-phenylethyl}-2,1,3-benzothiadiazole-4-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

C481-1500

Molecular Formula

C24H22FN5O3S2 (C24 H22 FN5 O3 S2)

Compound Name

N-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-1-phenylethyl}-2,1,3-benzothiadiazole-4-sulfonamide

IUPAC name

N-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-1-phenylethyl}-213-benzothiadiazole-4-sulfonamide

SMILES

O=C(C(c1ccccc1)NS(c1cccc2nsnc12)(=O)=O)N(CC1)CCN1c(cccc1)c1F

InChI

InChI=1S/C24H22FN5O3S2/c25-18-9-4-5-11-20(18)29-13-15-30(16-14-29)24(31)22(17-7-2-1-3-8-17)28-35(32,33)21-12-6-10-19-23(21)27-34-26-19/h1-12,22,28H,13-16H2/t22-/m1/s1

InChI Key

MGKWIJLZJZUZFB-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD14760732

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

511.6

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.494

Distribution Coefficient, logD

3.285

Water Solubility, LogSw

-3.75

Polar Surface Area

82.123

Acid Dissociation Constant (pKa)

7.61

Base Dissociation Constant (pKb)

2.25

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.80

C481-1500 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with C481-1500 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C481-1500?
Check Price and Availability of C481-1500, 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 C481-1500 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C481-1500
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C481-1500
  • 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 C481-1500 available by request