5695-0918 Screening compound: 2-[(2-PHENYL-4-QUINAZOLINYL)AMINO]ETHYL ISONICOTINATE

5695-0918 Screening compound: 2-[(2-PHENYL-4-QUINAZOLINYL)AMINO]ETHYL ISONICOTINATE
5695-0918 Screening compound: 2-[(2-PHENYL-4-QUINAZOLINYL)AMINO]ETHYL ISONICOTINATE alternative view

Chemical Structure Depiction of ChemDiv screening compound 5695-0918
2-[(2-PHENYL-4-QUINAZOLINYL)AMINO]ETHYL ISONICOTINATE

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

5695-0918

Molecular Formula

C22H18N4O2 (C22 H18 N4 O2)

Compound Name

2-[(2-PHENYL-4-QUINAZOLINYL)AMINO]ETHYL ISONICOTINATE

IUPAC name

n/a

SMILES

O=C(c1ccncc1)OCCNc1nc(-c2ccccc2)nc2ccccc12

InChI

InChI=1S/C22H18N4O2/c27-22(17-10-12-23-13-11-17)28-15-14-24-21-18-8-4-5-9-19(18)25-20(26-21)16-6-2-1-3-7-16/h1-13H,14-15H2,(H,24,25,26)

InChI Key

UCOQDPYKLWNFRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03786308

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

370.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.205

Distribution Coefficient, logD

4.939

Water Solubility, LogSw

-5.65

Polar Surface Area

59.445

Acid Dissociation Constant (pKa)

19.59

Base Dissociation Constant (pKb)

7.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.00

5695-0918 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5695-0918 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5695-0918?
Check Price and Availability of 5695-0918, 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 5695-0918 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5695-0918
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5695-0918
  • 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 5695-0918 available by request