S223-0292 Screening compound: N-({2-[(2-FLUOROPHENYL)SULFONYL]-8-OXA-2-AZASPIRO[4.5]DEC-4-YL}METHYL)-N,N-DIMETHYLAMINE
Chemical Structure Depiction of ChemDiv screening compound S223-0292
N-({2-[(2-FLUOROPHENYL)SULFONYL]-8-OXA-2-AZASPIRO[4.5]DEC-4-YL}METHYL)-N,N-DIMETHYLAMINE
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
S223-0292
Molecular Formula
C17H25FN2O3S (C17 H25 FN2 O3 S)
Compound Name
N-({2-[(2-FLUOROPHENYL)SULFONYL]-8-OXA-2-AZASPIRO[4.5]DEC-4-YL}METHYL)-N,N-DIMETHYLAMINE
IUPAC name
n/a
SMILES
CN(C)CC(CN(C1)S(c(cccc2)c2F)(=O)=O)C11CCOCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
356.46
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
1.574
Distribution Coefficient, logD
0.185
Water Solubility, LogSw
-2.21
Polar Surface Area
43.899
Acid Dissociation Constant (pKa)
27.47
Base Dissociation Constant (pKb)
8.77
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
64.70
S223-0292 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Antiviral Library (67538 compounds)
Bcl2-PPI Inhibitors Library (12246 compounds)
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)
MDM2-p53 interaction inhibitors Library (21687 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Cancer
- Hemic and lymphatic
- Cancer
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Cyclic compounds
- Cyclic compounds
References: we are preparing a list of scientific research reports with S223-0292 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)