6228-2408F Screening compound: 1-azepanyl{5-[(2-chlorophenoxy)methyl]-2-furyl}methanone
Chemical Structure Depiction of ChemDiv screening compound 6228-2408F
1-azepanyl{5-[(2-chlorophenoxy)methyl]-2-furyl}methanone
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
6228-2408F
Molecular Formula
C18H20ClNO3 (C18 H20 ClNO3)
Compound Name
1-azepanyl{5-[(2-chlorophenoxy)methyl]-2-furyl}methanone
IUPAC name
n/a
SMILES
O=C(c1ccc(COc(cccc2)c2Cl)o1)N1CCCCCC1
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
333.81
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.254
Distribution Coefficient, logD
4.254
Water Solubility, LogSw
-4.31
Polar Surface Area
32.373
Acid Dissociation Constant (pKa)
27.95
Base Dissociation Constant (pKb)
-0.11
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
38.90
References: we are preparing a list of scientific research reports with 6228-2408F 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)