D715-0753 Screening compound: 3-[4-oxo-1,2,3-benzotriazin-3(4H)-yl]-N-(5-quinolyl)propanamide

D715-0753 Screening compound: 3-[4-oxo-1,2,3-benzotriazin-3(4H)-yl]-N-(5-quinolyl)propanamide
D715-0753 Screening compound: 3-[4-oxo-1,2,3-benzotriazin-3(4H)-yl]-N-(5-quinolyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D715-0753
3-[4-oxo-1,2,3-benzotriazin-3(4H)-yl]-N-(5-quinolyl)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

D715-0753

Molecular Formula

C19H15N5O2 (C19 H15 N5 O2)

Compound Name

3-[4-oxo-1,2,3-benzotriazin-3(4H)-yl]-N-(5-quinolyl)propanamide

IUPAC name

3-(4-oxo-34-dihydro-123-benzotriazin-3-yl)-N-(quinolin-5-yl)propanamide

SMILES

O=C(CCN1N=Nc(cccc2)c2C1=O)Nc1cccc2ncccc12

InChI

InChI=1S/C19H15N5O2/c25-18(21-16-9-3-8-15-13(16)6-4-11-20-15)10-12-24-19(26)14-5-1-2-7-17(14)22-23-24/h1-9,11H,10,12H2,(H,21,25)

InChI Key

NHBHIZUWNSREBF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08743899

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.152

Distribution Coefficient, logD

2.151

Water Solubility, LogSw

-2.97

Polar Surface Area

72.125

Acid Dissociation Constant (pKa)

10.81

Base Dissociation Constant (pKb)

4.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.53

D715-0753 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D715-0753 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D715-0753?
Check Price and Availability of D715-0753, 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 D715-0753 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D715-0753
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D715-0753
  • 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 D715-0753 available by request