4466-2183 Screening compound: methyl 4-{[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]oxy}benzoate

4466-2183 Screening compound: methyl 4-{[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]oxy}benzoate
4466-2183 Screening compound: methyl 4-{[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]oxy}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4466-2183
methyl 4-{[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]oxy}benzoate

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

4466-2183

Molecular Formula

C17H19N3O4 (C17 H19 N3 O4)

Compound Name

methyl 4-{[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]oxy}benzoate

IUPAC name

methyl 4-{[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]oxy}benzoate

SMILES

Cc1cc(Oc(cc2)ccc2C(OC)=O)nc(N2CCOCC2)n1

InChI

InChI=1S/C17H19N3O4/c1-12-11-15(19-17(18-12)20-7-9-23-10-8-20)24-14-5-3-13(4-6-14)16(21)22-2/h3-6,11H,7-10H2,1-2H3

InChI Key

FDHIGLBMTNSTGV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02998971

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.988

Distribution Coefficient, logD

2.988

Water Solubility, LogSw

-3.19

Polar Surface Area

56.726

Acid Dissociation Constant (pKa)

20.87

Base Dissociation Constant (pKb)

3.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

4466-2183 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Agro:
  • Agro
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 4466-2183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4466-2183?
Check Price and Availability of 4466-2183, 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 4466-2183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4466-2183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4466-2183
  • 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 4466-2183 available by request