D305-0769 Screening compound: 3,4,5-trimethoxy-N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}benzamide

D305-0769 Screening compound: 3,4,5-trimethoxy-N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}benzamide
D305-0769 Screening compound: 3,4,5-trimethoxy-N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D305-0769
3,4,5-trimethoxy-N-{1-methyl-2-[(4-propanoylpiperazin-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

D305-0769

Molecular Formula

C26H33N5O5 (C26 H33 N5 O5)

Compound Name

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

IUPAC name

345-trimethoxy-N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-13-benzodiazol-5-yl}benzamide

SMILES

CCC(N1CCN(Cc2nc(cc(cc3)NC(c(cc4OC)cc(OC)c4OC)=O)c3n2C)CC1)=O

InChI

InChI=1S/C26H33N5O5/c1-6-24(32)31-11-9-30(10-12-31)16-23-28-19-15-18(7-8-20(19)29(23)2)27-26(33)17-13-21(34-3)25(36-5)22(14-17)35-4/h7-8,13-15H,6,9-12,16H2,1-5H3,(H,27,33)

InChI Key

SRHBAEKYMLAYHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27579746

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

495.58

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.076

Distribution Coefficient, logD

2.028

Water Solubility, LogSw

-3.14

Polar Surface Area

78.227

Acid Dissociation Constant (pKa)

12.50

Base Dissociation Constant (pKb)

6.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.30

D305-0769 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D305-0769 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D305-0769?
Check Price and Availability of D305-0769, 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 D305-0769 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D305-0769
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D305-0769
  • 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 D305-0769 available by request