S827-0285 Screening compound: [2-(3-CYCLOPROPYL-1,2,4-OXADIAZOL-5-YL)-4,4-DIFLUORO-1-PYRROLIDINYL](1-METHYL-4-PIPERIDYL)METHANONE
Chemical Structure Depiction of ChemDiv screening compound S827-0285
[2-(3-CYCLOPROPYL-1,2,4-OXADIAZOL-5-YL)-4,4-DIFLUORO-1-PYRROLIDINYL](1-METHYL-4-PIPERIDYL)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
S827-0285
Molecular Formula
C16H22F2N4O2 (C16 H22 F2 N4 O2)
Compound Name
[2-(3-CYCLOPROPYL-1,2,4-OXADIAZOL-5-YL)-4,4-DIFLUORO-1-PYRROLIDINYL](1-METHYL-4-PIPERIDYL)METHANONE
IUPAC name
n/a
SMILES
CN(CC1)CCC1C(N(CC(C1)(F)F)[C@@H]1c1nc(C2CC2)no1)=O
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
340.37
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
1.853
Distribution Coefficient, logD
-1.900
Water Solubility, LogSw
-1.76
Polar Surface Area
52.478
Acid Dissociation Constant (pKa)
23.93
Base Dissociation Constant (pKb)
11.15
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
81.30
S827-0285 in Drug Discovery
Included in Screening Libraries
GPCR Targeted Library (31838 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with S827-0285 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)