C520-0118 Screening compound: 1-(5-chloro-2-methylphenyl)-4-{5-[(4-methylbenzenesulfinyl)methyl]furan-2-carbonyl}piperazine

C520-0118 Screening compound: 1-(5-chloro-2-methylphenyl)-4-{5-[(4-methylbenzenesulfinyl)methyl]furan-2-carbonyl}piperazine
C520-0118 Screening compound: 1-(5-chloro-2-methylphenyl)-4-{5-[(4-methylbenzenesulfinyl)methyl]furan-2-carbonyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C520-0118
1-(5-chloro-2-methylphenyl)-4-{5-[(4-methylbenzenesulfinyl)methyl]furan-2-carbonyl}piperazine

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

C520-0118

Molecular Formula

C24H25ClN2O3S (C24 H25 ClN2 O3 S)

Compound Name

1-(5-chloro-2-methylphenyl)-4-{5-[(4-methylbenzenesulfinyl)methyl]furan-2-carbonyl}piperazine

IUPAC name

1-(5-chloro-2-methylphenyl)-4-{5-[(4-methylbenzenesulfinyl)methyl]furan-2-carbonyl}piperazine

SMILES

Cc(cc1)ccc1S(Cc1ccc(C(N(CC2)CCN2c2c(C)ccc(Cl)c2)=O)o1)=O

InChI

InChI=1S/C24H27ClN2O3S/c1-17-3-8-21(9-4-17)31(29)16-20-7-10-23(30-20)24(28)27-13-11-26(12-14-27)22-15-19(25)6-5-18(22)2/h3-10,15H,11-14,16,31H2,1-2H3

InChI Key

NTXBKBZUNOAHPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14765171

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.99

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.297

Distribution Coefficient, logD

5.297

Water Solubility, LogSw

-5.83

Polar Surface Area

42.828

Acid Dissociation Constant (pKa)

28.24

Base Dissociation Constant (pKb)

3.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

References: we are preparing a list of scientific research reports with C520-0118 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C520-0118?
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What is the minimum amount of C520-0118 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C520-0118
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C520-0118
  • 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 C520-0118 available by request