S610-0984 Screening compound: 2-[(4-methoxyphenyl)methyl]-7-(1-methyl-1H-pyrazole-5-carbonyl)-2,7-diazaspiro[3.5]nonan-1-one

S610-0984 Screening compound: 2-[(4-methoxyphenyl)methyl]-7-(1-methyl-1H-pyrazole-5-carbonyl)-2,7-diazaspiro[3.5]nonan-1-one
S610-0984 Screening compound: 2-[(4-methoxyphenyl)methyl]-7-(1-methyl-1H-pyrazole-5-carbonyl)-2,7-diazaspiro[3.5]nonan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S610-0984
2-[(4-methoxyphenyl)methyl]-7-(1-methyl-1H-pyrazole-5-carbonyl)-2,7-diazaspiro[3.5]nonan-1-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

S610-0984

Molecular Formula

C20H24N4O3 (C20 H24 N4 O3)

Compound Name

2-[(4-methoxyphenyl)methyl]-7-(1-methyl-1H-pyrazole-5-carbonyl)-2,7-diazaspiro[3.5]nonan-1-one

IUPAC name

2-[(4-methoxyphenyl)methyl]-7-(1-methyl-1H-pyrazole-5-carbonyl)-27-diazaspiro[3.5]nonan-1-one

SMILES

Cn1nccc1C(N(CC1)CCC1(CN1Cc(cc2)ccc2OC)C1=O)=O

InChI

InChI=1S/C20H24N4O3/c1-22-17(7-10-21-22)18(25)23-11-8-20(9-12-23)14-24(19(20)26)13-15-3-5-16(27-2)6-4-15/h3-7,10H,8-9,11-14H2,1-2H3

InChI Key

AQITZQGZVQAPSR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31990138

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.913

Distribution Coefficient, logD

0.913

Water Solubility, LogSw

-1.63

Polar Surface Area

54.692

Acid Dissociation Constant (pKa)

26.84

Base Dissociation Constant (pKb)

1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

S610-0984 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 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

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

References: we are preparing a list of scientific research reports with S610-0984 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S610-0984?
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What is the minimum amount of S610-0984 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S610-0984
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S610-0984
  • 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 S610-0984 available by request