5660-0160 Screening compound: 1-[3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-en-1-yl]-1-ethanone

5660-0160 Screening compound: 1-[3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-en-1-yl]-1-ethanone
5660-0160 Screening compound: 1-[3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-en-1-yl]-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound 5660-0160
1-[3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-en-1-yl]-1-ethanone

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

5660-0160

Molecular Formula

C15H17ClN2O2 (C15 H17 ClN2 O2)

Compound Name

1-[3-(3-chloro-4-methylphenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-en-1-yl]-1-ethanone

IUPAC name

1-[3-(3-chloro-4-methylphenyl)-4-oxa-12-diazaspiro[4.4]non-2-en-1-yl]ethan-1-one

SMILES

CC(N1N=C(c2cc(Cl)c(C)cc2)OC11CCCC1)=O

InChI

InChI=1S/C15H17ClN2O2/c1-10-5-6-12(9-13(10)16)14-17-18(11(2)19)15(20-14)7-3-4-8-15/h5-6,9H,3-4,7-8H2,1-2H3

InChI Key

YBHODASJLPYWDO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03827846

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.76

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.418

Distribution Coefficient, logD

3.418

Water Solubility, LogSw

-3.96

Polar Surface Area

34.423

Acid Dissociation Constant (pKa)

24.99

Base Dissociation Constant (pKb)

-1.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.67

5660-0160 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 5660-0160 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5660-0160?
Check Price and Availability of 5660-0160, 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 5660-0160 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5660-0160
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5660-0160
  • 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 5660-0160 available by request