F482-1413 Screening compound: N-[(3-chlorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]-4-(propan-2-yl)benzene-1-sulfonamide

F482-1413 Screening compound: N-[(3-chlorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]-4-(propan-2-yl)benzene-1-sulfonamide
F482-1413 Screening compound: N-[(3-chlorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]-4-(propan-2-yl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F482-1413
N-[(3-chlorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]-4-(propan-2-yl)benzene-1-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

F482-1413

Molecular Formula

C23H30ClN3O3S (C23 H30 ClN3 O3 S)

Compound Name

N-[(3-chlorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]-4-(propan-2-yl)benzene-1-sulfonamide

IUPAC name

N-[(3-chlorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]-4-(propan-2-yl)benzene-1-sulfonamide

SMILES

CC(C)c(cc1)ccc1S(N(CCC(N1CCNCC1)=O)Cc1cccc(Cl)c1)(=O)=O

InChI

InChI=1S/C23H30ClN3O3S/c1-18(2)20-6-8-22(9-7-20)31(29,30)27(17-19-4-3-5-21(24)16-19)13-10-23(28)26-14-11-25-12-15-26/h3-9,16,18,25H,10-15,17H2,1-2H3

InChI Key

AGXGDVDJASXPIJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14956021

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

464.03

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.610

Distribution Coefficient, logD

2.782

Water Solubility, LogSw

-4.13

Polar Surface Area

59.674

Acid Dissociation Constant (pKa)

23.81

Base Dissociation Constant (pKb)

8.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

F482-1413 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with F482-1413 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F482-1413?
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What is the minimum amount of F482-1413 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F482-1413
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F482-1413
  • 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 F482-1413 available by request