CM4412-1979 Screening compound: 4-(4-chlorobenzoyl)-1-(cyclopropylmethyl)-1,4-diazaspiro[5.5]undecan-2-one

CM4412-1979 Screening compound: 4-(4-chlorobenzoyl)-1-(cyclopropylmethyl)-1,4-diazaspiro[5.5]undecan-2-one
CM4412-1979 Screening compound: 4-(4-chlorobenzoyl)-1-(cyclopropylmethyl)-1,4-diazaspiro[5.5]undecan-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound CM4412-1979
4-(4-chlorobenzoyl)-1-(cyclopropylmethyl)-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

CM4412-1979

Molecular Formula

C20H25ClN2O2 (C20 H25 ClN2 O2)

Compound Name

4-(4-chlorobenzoyl)-1-(cyclopropylmethyl)-1,4-diazaspiro[5.5]undecan-2-one

IUPAC name

4-(4-chlorobenzoyl)-1-(cyclopropylmethyl)-14-diazaspiro[5.5]undecan-2-one

SMILES

O=C(c(cc1)ccc1Cl)N(CC1(CCCCC1)N1CC2CC2)CC1=O

InChI

InChI=1S/C20H25ClN2O2/c21-17-8-6-16(7-9-17)19(25)22-13-18(24)23(12-15-4-5-15)20(14-22)10-2-1-3-11-20/h6-9,15H,1-5,10-14H2

InChI Key

NYQCKVRCPQMSQF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30458914

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.88

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.456

Distribution Coefficient, logD

3.456

Water Solubility, LogSw

-3.90

Polar Surface Area

33.202

Acid Dissociation Constant (pKa)

23.07

Base Dissociation Constant (pKb)

2.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

CM4412-1979 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with CM4412-1979 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM4412-1979?
Check Price and Availability of CM4412-1979, 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 CM4412-1979 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM4412-1979
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM4412-1979
  • 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 CM4412-1979 available by request