3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate
TL;DR: 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate (CAS 840478-71-9) is a chemical compound with molecular formula C23H29NO2 and molecular weight 351.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(dimethylamino)-1-phenylpropyl] 1-phenylcyclopentane-1-carboxylate
Also Known As: AB01334676-02, 3-(dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate, (3-dimethylamino-1-phenyl-propyl) 1-phenylcyclopentane-1-carboxylate, [3-(dimethylamino)-1-phenylpropyl] 1-phenylcyclopentane-1-carboxylate
| Molecular Formula | C23H29NO2 |
|---|---|
| Molecular Weight | 351.22 g/mol |
| LogP | 4.7346 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 351.21982 |
| Heavy Atoms | 26 |
| Complexity | 690.6625 |
Chemical Identifiers
| CAS Number | 840478-71-9 |
|---|---|
| SMILES | CN(C)CCC(C1=CC=CC=C1)OC(=O)C2(CCCC2)C3=CC=CC=C3 |
Product Overview
3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate (CAS 840478-71-9), with molecular formula C23H29NO2 and molecular weight 351.22 g/mol. IUPAC: [3-(dimethylamino)-1-phenylpropyl] 1-phenylcyclopentane-1-carboxylate.
Chemical Property Profile of 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate
Property Insights of 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate
The XLogP value of 4.7346 indicates that 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate?
The CAS number of 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate is 840478-71-9.
What is the molecular formula of 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate?
The molecular formula of 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate is C23H29NO2.
What is the molecular weight of 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate?
The molecular weight of 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate is 351.22 g/mol.
Where can I buy 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate?
You can request a quote for 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Dimethylamino)-1-phenylpropyl 1-phenylcyclopentanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.