3497-0078 Screening compound: 6-chloro-2-phenyl-4-(piperidin-1-yl)quinazoline

3497-0078 Screening compound: 6-chloro-2-phenyl-4-(piperidin-1-yl)quinazoline
3497-0078 Screening compound: 6-chloro-2-phenyl-4-(piperidin-1-yl)quinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 3497-0078
6-chloro-2-phenyl-4-(piperidin-1-yl)quinazoline

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

3497-0078

Molecular Formula

C19H18ClN3 (C19 H18 ClN3)

Compound Name

6-chloro-2-phenyl-4-(piperidin-1-yl)quinazoline

IUPAC name

6-chloro-2-phenyl-4-(piperidin-1-yl)quinazoline

SMILES

Clc1cc2c(N3CCCCC3)nc(-c3ccccc3)nc2cc1

InChI

InChI=1S/C19H18ClN3/c20-15-9-10-17-16(13-15)19(23-11-5-2-6-12-23)22-18(21-17)14-7-3-1-4-8-14/h1,3-4,7-10,13H,2,5-6,11-12H2

InChI Key

RACDUDJYCUWVRR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00823083

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.82

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.326

Distribution Coefficient, logD

5.742

Water Solubility, LogSw

-6.56

Polar Surface Area

21.638

Acid Dissociation Constant (pKa)

21.62

Base Dissociation Constant (pKb)

7.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

3497-0078 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

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

CNS BBB Library (22607 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Nervous system
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3497-0078 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3497-0078?
Check Price and Availability of 3497-0078, 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 3497-0078 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3497-0078
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3497-0078
  • 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 3497-0078 available by request