C741-0020 Screening compound: 3-(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)-N-(3-morpholinopropyl)propanamide

C741-0020 Screening compound: 3-(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)-N-(3-morpholinopropyl)propanamide
C741-0020 Screening compound: 3-(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)-N-(3-morpholinopropyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C741-0020
3-(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)-N-(3-morpholinopropyl)propanamide

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

C741-0020

Molecular Formula

C26H30N6O3 (C26 H30 N6 O3)

Compound Name

3-(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)-N-(3-morpholinopropyl)propanamide

IUPAC name

3-{4-benzyl-5-oxo-4H5H-[124]triazolo[43-a]quinazolin-1-yl}-N-[3-(morpholin-4-yl)propyl]propanamide

SMILES

O=C(CCc(n1-c2c3cccc2)nnc1N(Cc1ccccc1)C3=O)NCCCN1CCOCC1

InChI

InChI=1S/C26H30N6O3/c33-24(27-13-6-14-30-15-17-35-18-16-30)12-11-23-28-29-26-31(19-20-7-2-1-3-8-20)25(34)21-9-4-5-10-22(21)32(23)26/h1-5,7-10H,6,11-19H2,(H,27,33)

InChI Key

UKNFVKCFMWOCIH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14790563

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.936

Distribution Coefficient, logD

0.513

Water Solubility, LogSw

-2.31

Polar Surface Area

75.910

Acid Dissociation Constant (pKa)

15.52

Base Dissociation Constant (pKb)

7.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.46

C741-0020 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C741-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C741-0020?
Check Price and Availability of C741-0020, 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 C741-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C741-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C741-0020
  • 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 C741-0020 available by request