Y300-0206 Screening compound: 1-[(3-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound Y300-0206
1-[(3-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
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
Y300-0206
Molecular Formula
C24H30N2O (C24 H30 N2 O)
Compound Name
1-[(3-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
IUPAC name
1-[(3-methylphenyl)methyl]-N-(1234-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
SMILES
Cc1cccc(CN(CC2)CCC2C(NC(CCC2)c3c2cccc3)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
362.52
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
4.369
Distribution Coefficient, logD
1.468
Water Solubility, LogSw
-4.19
Polar Surface Area
28.228
Acid Dissociation Constant (pKa)
11.58
Base Dissociation Constant (pKb)
10.30
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
45.80
Y300-0206 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
CNS BBB Library (22607 compounds)
CORONAVIRUS Library (20774 compounds)
Neurotransmitter Transporter Inhibitors Library (11024 compounds)
PLpro Library (6343 compounds)
PD-1/L1 Library (498 compounds)
Included in 1.7M Stock Database
- Nervous system
- Antiviral
- Infections
- Immune system
- Nervous system
- Antiviral
- Infections
- Immune system
- Cancer
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Immune system
- GPCR
- Ion Channels
- Others
References: we are preparing a list of scientific research reports with Y300-0206 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)