6049-1986 Screening compound: 4-methyl-N-{2-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]ethyl}benzene-1-sulfonamide

6049-1986 Screening compound: 4-methyl-N-{2-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]ethyl}benzene-1-sulfonamide
6049-1986 Screening compound: 4-methyl-N-{2-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]ethyl}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6049-1986
4-methyl-N-{2-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]ethyl}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

6049-1986

Molecular Formula

C20H27N3O4S2 (C20 H27 N3 O4 S2)

Compound Name

4-methyl-N-{2-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]ethyl}benzene-1-sulfonamide

IUPAC name

4-methyl-N-{2-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]ethyl}benzene-1-sulfonamide

SMILES

Cc(cc1)ccc1S(NCCN(CC1)CCN1S(c1ccc(C)cc1)(=O)=O)(=O)=O

InChI

InChI=1S/C20H27N3O4S2/c1-17-3-7-19(8-4-17)28(24,25)21-11-12-22-13-15-23(16-14-22)29(26,27)20-9-5-18(2)6-10-20/h3-10,21H,11-16H2,1-2H3

InChI Key

ZYVWZVBUZKKDEZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03403551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.58

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.164

Distribution Coefficient, logD

3.163

Water Solubility, LogSw

-3.39

Polar Surface Area

77.340

Acid Dissociation Constant (pKa)

11.61

Base Dissociation Constant (pKb)

4.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

6049-1986 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6049-1986 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6049-1986?
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What is the minimum amount of 6049-1986 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6049-1986
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6049-1986
  • 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 6049-1986 available by request