D305-0773 Screening compound: N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-2-(4-methylphenoxy)acetamide

D305-0773 Screening compound: N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-2-(4-methylphenoxy)acetamide
D305-0773 Screening compound: N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-2-(4-methylphenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D305-0773
N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-2-(4-methylphenoxy)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

D305-0773

Molecular Formula

C25H31N5O3 (C25 H31 N5 O3)

Compound Name

N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-2-(4-methylphenoxy)acetamide

IUPAC name

N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-13-benzodiazol-5-yl}-2-(4-methylphenoxy)acetamide

SMILES

CCC(N1CCN(Cc2nc(cc(cc3)NC(COc4ccc(C)cc4)=O)c3n2C)CC1)=O

InChI

InChI=1S/C25H31N5O3/c1-4-25(32)30-13-11-29(12-14-30)16-23-27-21-15-19(7-10-22(21)28(23)3)26-24(31)17-33-20-8-5-18(2)6-9-20/h5-10,15H,4,11-14,16-17H2,1-3H3,(H,26,31)

InChI Key

XCTZBEVBKAZXFW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09766999

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.753

Distribution Coefficient, logD

2.159

Water Solubility, LogSw

-3.13

Polar Surface Area

62.535

Acid Dissociation Constant (pKa)

12.44

Base Dissociation Constant (pKb)

7.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

D305-0773 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D305-0773 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D305-0773?
Check Price and Availability of D305-0773, 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 D305-0773 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D305-0773
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D305-0773
  • 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 D305-0773 available by request