S610-0148 Screening compound: 2-phenyl-7-phenylmethanesulfonyl-2,7-diazaspiro[3.5]nonan-1-one
Chemical Structure Depiction of ChemDiv screening compound S610-0148
2-phenyl-7-phenylmethanesulfonyl-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
S610-0148
Molecular Formula
C20H22N2O3S (C20 H22 N2 O3 S)
Compound Name
2-phenyl-7-phenylmethanesulfonyl-2,7-diazaspiro[3.5]nonan-1-one
IUPAC name
2-phenyl-7-phenylmethanesulfonyl-27-diazaspiro[3.5]nonan-1-one
SMILES
O=C(C(C1)(CC2)CCN2S(Cc2ccccc2)(=O)=O)N1c1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
370.47
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
2.608
Distribution Coefficient, logD
2.608
Water Solubility, LogSw
-2.81
Polar Surface Area
48.009
Acid Dissociation Constant (pKa)
20.60
Base Dissociation Constant (pKb)
2.64
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
35.00
S610-0148 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)
Anti-HIV1 Library (19540 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Cyclic compounds
- Cyclic compounds
- Antiviral
- Infections
- Immune system
References: we are preparing a list of scientific research reports with S610-0148 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)