8011-7972 Screening compound: 2-tert-butyl-4-(piperidin-1-yl)quinazoline

8011-7972 Screening compound: 2-tert-butyl-4-(piperidin-1-yl)quinazoline
8011-7972 Screening compound: 2-tert-butyl-4-(piperidin-1-yl)quinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-7972
2-tert-butyl-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

8011-7972

Molecular Formula

C17H23N3 (C17 H23 N3)

Compound Name

2-tert-butyl-4-(piperidin-1-yl)quinazoline

IUPAC name

2-tert-butyl-4-(piperidin-1-yl)quinazoline

SMILES

CC(C)(C)c1nc2ccccc2c(N2CCCCC2)n1

InChI

InChI=1S/C17H23N3/c1-17(2,3)16-18-14-10-6-5-9-13(14)15(19-16)20-11-7-4-8-12-20/h5-6,9-10H,4,7-8,11-12H2,1-3H3

InChI Key

QBQLWJJDVJLYAH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02951342

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

269.39

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

4.958

Distribution Coefficient, logD

4.080

Water Solubility, LogSw

-4.78

Polar Surface Area

21.910

Acid Dissociation Constant (pKa)

22.01

Base Dissociation Constant (pKb)

8.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.90

8011-7972 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Ion Channels Focused Library (26372 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Agro:
  • Agro
Targets:
  • Ion Channels
  • Phosphatases

References: we are preparing a list of scientific research reports with 8011-7972 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-7972?
Check Price and Availability of 8011-7972, 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 8011-7972 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-7972
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-7972
  • 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 8011-7972 available by request