C430-0560 Screening compound: 3-(4-chlorophenoxy)-4-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1-(2-methylphenyl)azetidin-2-one

C430-0560 Screening compound: 3-(4-chlorophenoxy)-4-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1-(2-methylphenyl)azetidin-2-one
C430-0560 Screening compound: 3-(4-chlorophenoxy)-4-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1-(2-methylphenyl)azetidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C430-0560
3-(4-chlorophenoxy)-4-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1-(2-methylphenyl)azetidin-2-one

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

C430-0560

Molecular Formula

C27H29ClN2O4 (C27 H29 ClN2 O4)

Compound Name

3-(4-chlorophenoxy)-4-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1-(2-methylphenyl)azetidin-2-one

IUPAC name

3-(4-chlorophenoxy)-4-({[2-(34-dimethoxyphenyl)ethyl]amino}methyl)-1-(2-methylphenyl)azetidin-2-one

SMILES

Cc(cccc1)c1N(C(CNCCc(cc1)cc(OC)c1OC)C1Oc(cc2)ccc2Cl)C1=O

InChI

InChI=1S/C27H29ClN2O4/c1-18-6-4-5-7-22(18)30-23(26(27(30)31)34-21-11-9-20(28)10-12-21)17-29-15-14-19-8-13-24(32-2)25(16-19)33-3/h4-13,16,23,26,29H,14-15,17H2,1-3H3

InChI Key

KGBAGMMEYDMGKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14756584

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

480.99

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.865

Distribution Coefficient, logD

3.572

Water Solubility, LogSw

-4.41

Polar Surface Area

48.581

Acid Dissociation Constant (pKa)

20.39

Base Dissociation Constant (pKb)

7.38

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

29.60

C430-0560 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS targets activity set (6557 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C430-0560 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C430-0560?
Check Price and Availability of C430-0560, 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 C430-0560 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C430-0560
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C430-0560
  • 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 C430-0560 available by request