4248-0382 Screening compound: 4-(azepan-1-yl)-2-(4-chlorophenyl)quinazoline

4248-0382 Screening compound: 4-(azepan-1-yl)-2-(4-chlorophenyl)quinazoline
4248-0382 Screening compound: 4-(azepan-1-yl)-2-(4-chlorophenyl)quinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 4248-0382
4-(azepan-1-yl)-2-(4-chlorophenyl)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

4248-0382

Molecular Formula

C20H20ClN3 (C20 H20 ClN3)

Compound Name

4-(azepan-1-yl)-2-(4-chlorophenyl)quinazoline

IUPAC name

4-(azepan-1-yl)-2-(4-chlorophenyl)quinazoline

SMILES

Clc(cc1)ccc1-c1nc2ccccc2c(N2CCCCCC2)n1

InChI

InChI=1S/C20H20ClN3/c21-16-11-9-15(10-12-16)19-22-18-8-4-3-7-17(18)20(23-19)24-13-5-1-2-6-14-24/h3-4,7-12H,1-2,5-6,13-14H2

InChI Key

JGDDAICMGREMOU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01854691

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.85

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

6.723

Distribution Coefficient, logD

6.138

Water Solubility, LogSw

-6.88

Polar Surface Area

21.969

Acid Dissociation Constant (pKa)

22.80

Base Dissociation Constant (pKb)

7.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

4248-0382 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 4248-0382 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4248-0382?
Check Price and Availability of 4248-0382, 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 4248-0382 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4248-0382
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4248-0382
  • 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 4248-0382 available by request