4593-2691 Screening compound: 4-(2,6-dimethylmorpholin-4-yl)-2-(4-methylphenyl)quinazoline

4593-2691 Screening compound: 4-(2,6-dimethylmorpholin-4-yl)-2-(4-methylphenyl)quinazoline
4593-2691 Screening compound: 4-(2,6-dimethylmorpholin-4-yl)-2-(4-methylphenyl)quinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 4593-2691
4-(2,6-dimethylmorpholin-4-yl)-2-(4-methylphenyl)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

4593-2691

Molecular Formula

C21H23N3O (C21 H23 N3 O)

Compound Name

4-(2,6-dimethylmorpholin-4-yl)-2-(4-methylphenyl)quinazoline

IUPAC name

4-(26-dimethylmorpholin-4-yl)-2-(4-methylphenyl)quinazoline

SMILES

CC(C1)OC(C)CN1c1nc(-c2ccc(C)cc2)nc2ccccc12

InChI

InChI=1S/C21H23N3O/c1-14-8-10-17(11-9-14)20-22-19-7-5-4-6-18(19)21(23-20)24-12-15(2)25-16(3)13-24/h4-11,15-16H,12-13H2,1-3H3

InChI Key

XTJUHZVQYUMZEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05026452

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.178

Distribution Coefficient, logD

3.949

Water Solubility, LogSw

-5.31

Polar Surface Area

28.571

Acid Dissociation Constant (pKa)

23.03

Base Dissociation Constant (pKb)

8.60

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

33.30

4593-2691 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with 4593-2691 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4593-2691?
Check Price and Availability of 4593-2691, 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 4593-2691 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4593-2691
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4593-2691
  • 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 4593-2691 available by request