CM4557-0497 Screening compound: 1-methyl-4-[(4-propoxyphenyl)methyl]-9-oxa-1,4-diazaspiro[5.5]undecan-2-one

CM4557-0497 Screening compound: 1-methyl-4-[(4-propoxyphenyl)methyl]-9-oxa-1,4-diazaspiro[5.5]undecan-2-one
CM4557-0497 Screening compound: 1-methyl-4-[(4-propoxyphenyl)methyl]-9-oxa-1,4-diazaspiro[5.5]undecan-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound CM4557-0497
1-methyl-4-[(4-propoxyphenyl)methyl]-9-oxa-1,4-diazaspiro[5.5]undecan-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

CM4557-0497

Molecular Formula

C19H28N2O3 (C19 H28 N2 O3)

Compound Name

1-methyl-4-[(4-propoxyphenyl)methyl]-9-oxa-1,4-diazaspiro[5.5]undecan-2-one

IUPAC name

1-methyl-4-[(4-propoxyphenyl)methyl]-9-oxa-14-diazaspiro[5.5]undecan-2-one

SMILES

CCCOc1ccc(CN(CC2(CCOCC2)N2C)CC2=O)cc1

InChI

InChI=1S/C19H28N2O3/c1-3-10-24-17-6-4-16(5-7-17)13-21-14-18(22)20(2)19(15-21)8-11-23-12-9-19/h4-7H,3,8-15H2,1-2H3

InChI Key

ZVTAKFVCJYIPKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30459609

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.199

Distribution Coefficient, logD

1.859

Water Solubility, LogSw

-2.38

Polar Surface Area

35.126

Acid Dissociation Constant (pKa)

23.19

Base Dissociation Constant (pKb)

7.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.16

CM4557-0497 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS MPO Library (28609 compounds)

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with CM4557-0497 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM4557-0497?
Check Price and Availability of CM4557-0497, 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 CM4557-0497 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM4557-0497
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM4557-0497
  • 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 CM4557-0497 available by request