S026-1008 Screening compound: N-cyclopentyl-1'H-spiro[piperidine-3,2'-pyrido[2,3-b]pyrazin]-3'-amine
Chemical Structure Depiction of ChemDiv screening compound S026-1008
N-cyclopentyl-1'H-spiro[piperidine-3,2'-pyrido[2,3-b]pyrazin]-3'-amine
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
S026-1008
Molecular Formula
C16H23N5 (C16 H23 N5)
Compound Name
N-cyclopentyl-1'H-spiro[piperidine-3,2'-pyrido[2,3-b]pyrazin]-3'-amine
IUPAC name
N-cyclopentyl-1'H-spiro[piperidine-32'-pyrido[23-b]pyrazin]-3'-amine
SMILES
C(CC1)CC1NC1=Nc2ncccc2NC11CNCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
285.39
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
1.615
Distribution Coefficient, logD
0.856
Water Solubility, LogSw
-1.44
Polar Surface Area
53.835
Acid Dissociation Constant (pKa)
17.34
Base Dissociation Constant (pKb)
8.08
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
62.50
S026-1008 in Drug Discovery
Included in Screening Libraries
3D-Fragment Library (4274 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
Protein-Protein Interaction Library (218420 compounds)
Soluble Diversity Library (15920 compounds)
Spiro Library (21655 compounds)
TLR-8 ligands Library (674 compounds)
Akt-Targeted Library (14764 compounds)
Anti-HIV1 Library (19540 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- 3D
- Fragments
- Cyclic compounds
- Cyclic compounds
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Female
- Skin
- Immune system
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Skin
- Antiviral
- Infections
- Immune system
- Others
- Others
- Kinases
- Epigenetic
- PPI modulators
- PPI modulators
- Receptor's ligands
References: we are preparing a list of scientific research reports with S026-1008 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)