S665-0030 Screening compound: (2,4-DIMETHOXYPHENYL)(1-ETHYL-1-HYDROXY-7-AZASPIRO[3.5]NON-7-YL)METHANONE

S665-0030 Screening compound: (2,4-DIMETHOXYPHENYL)(1-ETHYL-1-HYDROXY-7-AZASPIRO[3.5]NON-7-YL)METHANONE
S665-0030 Screening compound: (2,4-DIMETHOXYPHENYL)(1-ETHYL-1-HYDROXY-7-AZASPIRO[3.5]NON-7-YL)METHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound S665-0030
(2,4-DIMETHOXYPHENYL)(1-ETHYL-1-HYDROXY-7-AZASPIRO[3.5]NON-7-YL)METHANONE

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

S665-0030

Molecular Formula

C19H27NO4 (C19 H27 NO4)

Compound Name

(2,4-DIMETHOXYPHENYL)(1-ETHYL-1-HYDROXY-7-AZASPIRO[3.5]NON-7-YL)METHANONE

IUPAC name

7-(24-dimethoxybenzoyl)-1-ethyl-7-azaspiro[3.5]nonan-1-ol

SMILES

CCC(CC1)(C1(CC1)CCN1C(c(ccc(OC)c1)c1OC)=O)O

InChI

InChI=1S/C19H27NO4/c1-4-19(22)8-7-18(19)9-11-20(12-10-18)17(21)15-6-5-14(23-2)13-16(15)24-3/h5-6,13,22H,4,7-12H2,1-3H3/t19-/m0/s1

InChI Key

KARRXKRHCKWLEC-IBGZPJMESA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.383

Distribution Coefficient, logD

2.383

Water Solubility, LogSw

-2.63

Polar Surface Area

47.779

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

-1.92

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.16

S665-0030 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 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

Structure:
  • 3D
  • Cyclic compounds
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with S665-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S665-0030?
Check Price and Availability of S665-0030, 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 S665-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S665-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S665-0030
  • 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 S665-0030 available by request