8006-9236 Screening compound: N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-[N-(4-methoxyphenyl)4-methylbenzenesulfonamido]acetamide

8006-9236 Screening compound: N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-[N-(4-methoxyphenyl)4-methylbenzenesulfonamido]acetamide
8006-9236 Screening compound: N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-[N-(4-methoxyphenyl)4-methylbenzenesulfonamido]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-9236
N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-[N-(4-methoxyphenyl)4-methylbenzenesulfonamido]acetamide

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

8006-9236

Molecular Formula

C24H25ClN2O4S2 (C24 H25 ClN2 O4 S2)

Compound Name

N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-[N-(4-methoxyphenyl)4-methylbenzenesulfonamido]acetamide

IUPAC name

N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-[N-(4-methoxyphenyl)4-methylbenzenesulfonamido]acetamide

SMILES

Cc(cc1)ccc1S(N(CC(NCCSc(cc1)ccc1Cl)=O)c(cc1)ccc1OC)(=O)=O

InChI

InChI=1S/C24H25ClN2O4S2/c1-18-3-13-23(14-4-18)33(29,30)27(20-7-9-21(31-2)10-8-20)17-24(28)26-15-16-32-22-11-5-19(25)6-12-22/h3-14H,15-17H2,1-2H3,(H,26,28)

InChI Key

PXTAGGUUDJXIBR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00827361

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

505.06

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.992

Distribution Coefficient, logD

4.992

Water Solubility, LogSw

-5.05

Polar Surface Area

63.649

Acid Dissociation Constant (pKa)

14.93

Base Dissociation Constant (pKb)

-0.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

References: we are preparing a list of scientific research reports with 8006-9236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-9236?
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What is the minimum amount of 8006-9236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-9236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-9236
  • 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 8006-9236 available by request