K673-0167 Screening compound: 1-(4-methoxyphenyl)-4-{4-[(4-methylphenyl)methanesulfonyl]-3-nitrobenzoyl}piperazine

K673-0167 Screening compound: 1-(4-methoxyphenyl)-4-{4-[(4-methylphenyl)methanesulfonyl]-3-nitrobenzoyl}piperazine
K673-0167 Screening compound: 1-(4-methoxyphenyl)-4-{4-[(4-methylphenyl)methanesulfonyl]-3-nitrobenzoyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound K673-0167
1-(4-methoxyphenyl)-4-{4-[(4-methylphenyl)methanesulfonyl]-3-nitrobenzoyl}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

K673-0167

Molecular Formula

C26H27N3O6S (C26 H27 N3 O6 S)

Compound Name

1-(4-methoxyphenyl)-4-{4-[(4-methylphenyl)methanesulfonyl]-3-nitrobenzoyl}piperazine

IUPAC name

1-(4-methoxyphenyl)-4-{4-[(4-methylphenyl)methanesulfonyl]-3-nitrobenzoyl}piperazine

SMILES

Cc1ccc(CS(c(ccc(C(N(CC2)CCN2c(cc2)ccc2OC)=O)c2)c2[N+]([O-])=O)(=O)=O)cc1

InChI

InChI=1S/C26H27N3O6S/c1-19-3-5-20(6-4-19)18-36(33,34)25-12-7-21(17-24(25)29(31)32)26(30)28-15-13-27(14-16-28)22-8-10-23(35-2)11-9-22/h3-12,17H,13-16,18H2,1-2H3

InChI Key

WNYJDAIDZZTHEI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02936237

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

509.58

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.950

Distribution Coefficient, logD

3.950

Water Solubility, LogSw

-4.12

Polar Surface Area

89.536

Acid Dissociation Constant (pKa)

19.71

Base Dissociation Constant (pKb)

2.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

K673-0167 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K673-0167 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K673-0167?
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What is the minimum amount of K673-0167 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K673-0167
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K673-0167
  • 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 K673-0167 available by request