M308-0066 Screening compound: 3-(2-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}ethyl)-N-(4-methylphenyl)piperidine-1-carboxamide
Chemical Structure Depiction of ChemDiv screening compound M308-0066
3-(2-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}ethyl)-N-(4-methylphenyl)piperidine-1-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
M308-0066
Molecular Formula
C24H35N3O2 (C24 H35 N3 O2)
Compound Name
3-(2-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}ethyl)-N-(4-methylphenyl)piperidine-1-carboxamide
IUPAC name
3-(2-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}ethyl)-N-(4-methylphenyl)piperidine-1-carboxamide
SMILES
Cc(cc1)ccc1NC(N1CC(CCC(NCCC2=CCCCC2)=O)CCC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
397.56
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.101
Distribution Coefficient, logD
4.101
Water Solubility, LogSw
-4.08
Polar Surface Area
49.875
Acid Dissociation Constant (pKa)
13.90
Base Dissociation Constant (pKb)
-0.51
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
58.30
M308-0066 in Drug Discovery
Included in Screening Libraries
Lipid Metabolism Library (9174 compounds)
PPI Helix Turn 3D-Mimetics Library (71298 compounds)
Protein-Protein Interaction Library (218420 compounds)
SmartTM Library (51161 compounds)
Alpha-Helix Mimetics Library (25899 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- Cardiovascular
- Metabolic
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Mimetics
- Cyclic compounds
References: we are preparing a list of scientific research reports with M308-0066 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)