J007-0783 Screening compound: 2-(2-chlorophenyl)-N-(3-ethoxypropyl)azepane-1-carboxamide
Chemical Structure Depiction of ChemDiv screening compound J007-0783
2-(2-chlorophenyl)-N-(3-ethoxypropyl)azepane-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
J007-0783
Molecular Formula
C18H27ClN2O2 (C18 H27 ClN2 O2)
Compound Name
2-(2-chlorophenyl)-N-(3-ethoxypropyl)azepane-1-carboxamide
IUPAC name
2-(2-chlorophenyl)-N-(3-ethoxypropyl)azepane-1-carboxamide
SMILES
CCOCCCNC(N(CCCCC1)C1c(cccc1)c1Cl)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
338.88
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.337
Distribution Coefficient, logD
4.337
Water Solubility, LogSw
-4.31
Polar Surface Area
34.874
Acid Dissociation Constant (pKa)
17.87
Base Dissociation Constant (pKb)
1.28
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
61.10
J007-0783 in Drug Discovery
Included in Screening Libraries
Cardiovascular Library (22201 compounds)
Protein-Protein Interaction Library (218420 compounds)
Neuropeptide S Library (2850 compounds)
Recognition Elements PPI Library (24135 compounds)
Included in 1.7M Stock Database
- Cardiovascular
- Digestive system
- Nervous system
- PPI modulators
- Receptor's ligands
- PPI modulators
- GPCR
- Mimetics
References: we are preparing a list of scientific research reports with J007-0783 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)