D305-0328 Screening compound: 2-(2-chlorophenoxy)-N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-(propan-2-yl)-1H-1,3-benzodiazol-5-yl}acetamide

D305-0328 Screening compound: 2-(2-chlorophenoxy)-N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-(propan-2-yl)-1H-1,3-benzodiazol-5-yl}acetamide
D305-0328 Screening compound: 2-(2-chlorophenoxy)-N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-(propan-2-yl)-1H-1,3-benzodiazol-5-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D305-0328
2-(2-chlorophenoxy)-N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-(propan-2-yl)-1H-1,3-benzodiazol-5-yl}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

D305-0328

Molecular Formula

C25H32ClN5O2 (C25 H32 ClN5 O2)

Compound Name

2-(2-chlorophenoxy)-N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-(propan-2-yl)-1H-1,3-benzodiazol-5-yl}acetamide

IUPAC name

2-(2-chlorophenoxy)-N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-(propan-2-yl)-1H-13-benzodiazol-5-yl}acetamide

SMILES

CCN1CCN(Cc2nc(cc(cc3)NC(COc(cccc4)c4Cl)=O)c3n2C(C)C)CC1

InChI

InChI=1S/C25H32ClN5O2/c1-4-29-11-13-30(14-12-29)16-24-28-21-15-19(9-10-22(21)31(24)18(2)3)27-25(32)17-33-23-8-6-5-7-20(23)26/h5-10,15,18H,4,11-14,16-17H2,1-3H3,(H,27,32)

InChI Key

MDPZUSQTJLNUAB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14279840

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.01

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.775

Distribution Coefficient, logD

2.664

Water Solubility, LogSw

-3.95

Polar Surface Area

50.223

Acid Dissociation Constant (pKa)

12.44

Base Dissociation Constant (pKb)

8.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

D305-0328 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with D305-0328 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D305-0328?
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What is the minimum amount of D305-0328 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D305-0328
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D305-0328
  • 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 D305-0328 available by request