Y020-1980 Screening compound: 7-[4-(2-fluorophenyl)piperazin-1-yl]-9-oxo-6,8-diazaspiro[4.5]dec-7-ene-10-carbonitrile
Chemical Structure Depiction of ChemDiv screening compound Y020-1980
7-[4-(2-fluorophenyl)piperazin-1-yl]-9-oxo-6,8-diazaspiro[4.5]dec-7-ene-10-carbonitrile
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
Y020-1980
Molecular Formula
C19H22FN5O (C19 H22 FN5 O)
Compound Name
7-[4-(2-fluorophenyl)piperazin-1-yl]-9-oxo-6,8-diazaspiro[4.5]dec-7-ene-10-carbonitrile
IUPAC name
7-[4-(2-fluorophenyl)piperazin-1-yl]-9-oxo-68-diazaspiro[4.5]dec-7-ene-10-carbonitrile
SMILES
N#CC(C1(CCCC1)NC(N(CC1)CCN1c(cccc1)c1F)=N1)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
355.42
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.090
Distribution Coefficient, logD
-2.903
Water Solubility, LogSw
-2.85
Polar Surface Area
59.329
Acid Dissociation Constant (pKa)
4.58
Base Dissociation Constant (pKb)
3.92
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
52.60
Y020-1980 in Drug Discovery
Included in Screening Libraries
GPCR Targeted Library (31838 compounds)
Integrin Receptors Targeted library (1715 compounds)
Anti-HIV1 Library (19540 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Cancer
- Musculoskeletal
- Digestive system
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Immune system
- Antiviral
- Infections
- Immune system
- GPCR
- Others
- Receptor's ligands
- Agro
References: we are preparing a list of scientific research reports with Y020-1980 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)