E647-0150 Screening compound: N-cyclohexyl-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)acetamide
Chemical Structure Depiction of ChemDiv screening compound E647-0150
N-cyclohexyl-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)acetamide
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
E647-0150
Molecular Formula
C18H24N2O2 (C18 H24 N2 O2)
Compound Name
N-cyclohexyl-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)acetamide
IUPAC name
N-cyclohexyl-2-(2-oxo-2345-tetrahydro-1H-1-benzazepin-1-yl)acetamide
SMILES
O=C(CN(c1c(CCC2)cccc1)C2=O)NC1CCCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
300.4
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
3.390
Distribution Coefficient, logD
3.390
Water Solubility, LogSw
-3.65
Polar Surface Area
40.147
Acid Dissociation Constant (pKa)
15.47
Base Dissociation Constant (pKb)
4.89
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
55.60
E647-0150 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
Allosteric Kinases Inhibitors Library (23117 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
CNS MPO Library (28609 compounds)
Protein-Protein Interaction Library (218420 compounds)
SmartTM Library (51161 compounds)
Soluble Diversity Library (15920 compounds)
Targeted Diversity Library (40567 compounds)
Recognition Elements PPI Library (24135 compounds)
Included in 1.7M Stock Database
- 3D
- Mimetics
- Cancer
- Female
- Congenital
- Skin
- Nervous system
- Kinases
- PPI modulators
- PPI modulators
References: we are preparing a list of scientific research reports with E647-0150 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)