6724-0420 Screening compound: 3,5-dimethyl-1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}piperidine
Chemical Structure Depiction of ChemDiv screening compound 6724-0420
3,5-dimethyl-1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}piperidine
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
6724-0420
Molecular Formula
C19H31NO (C19 H31 NO)
Compound Name
3,5-dimethyl-1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}piperidine
IUPAC name
35-dimethyl-1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}piperidine
SMILES
CC(C)c(ccc(C)c1)c1OCCN1CC(C)CC(C)C1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
289.46
Hydrogen Bond Acceptors Count
2.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
2
Partition Coefficient, logP
5.477
Distribution Coefficient, logD
3.515
Water Solubility, LogSw
-5.36
Polar Surface Area
11.321
Acid Dissociation Constant (pKa)
24.08
Base Dissociation Constant (pKb)
9.36
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
68.40
6724-0420 in Drug Discovery
Included in Screening Libraries
Cardiovascular Library (22201 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Cardiovascular
- Agro
References: we are preparing a list of scientific research reports with 6724-0420 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)