D305-1025 Screening compound: 4-chloro-N-{1-ethyl-2-[(4-methanesulfonylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}benzamide

D305-1025 Screening compound: 4-chloro-N-{1-ethyl-2-[(4-methanesulfonylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}benzamide
D305-1025 Screening compound: 4-chloro-N-{1-ethyl-2-[(4-methanesulfonylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D305-1025
4-chloro-N-{1-ethyl-2-[(4-methanesulfonylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}benzamide

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

D305-1025

Molecular Formula

C22H26ClN5O3S (C22 H26 ClN5 O3 S)

Compound Name

4-chloro-N-{1-ethyl-2-[(4-methanesulfonylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}benzamide

IUPAC name

4-chloro-N-{1-ethyl-2-[(4-methanesulfonylpiperazin-1-yl)methyl]-1H-13-benzodiazol-5-yl}benzamide

SMILES

CCn1c(ccc(NC(c(cc2)ccc2Cl)=O)c2)c2nc1CN(CC1)CCN1S(C)(=O)=O

InChI

InChI=1S/C22H26ClN5O3S/c1-3-28-20-9-8-18(24-22(29)16-4-6-17(23)7-5-16)14-19(20)25-21(28)15-26-10-12-27(13-11-26)32(2,30)31/h4-9,14H,3,10-13,15H2,1-2H3,(H,24,29)

InChI Key

OXZNCTCGEHADDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14279853

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.905

Distribution Coefficient, logD

2.901

Water Solubility, LogSw

-3.73

Polar Surface Area

69.246

Acid Dissociation Constant (pKa)

10.04

Base Dissociation Constant (pKb)

5.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

D305-1025 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with D305-1025 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D305-1025?
Check Price and Availability of D305-1025, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D305-1025 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D305-1025
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D305-1025
  • 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 D305-1025 available by request