1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate
TL;DR: 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate (CAS 372085-31-9) is a chemical compound with molecular formula C18H29NO3 and molecular weight 307.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(diethylamino)-3-phenylmethoxypropan-2-yl] butanoate
Also Known As: 1-(benzyloxy)-3-(diethylamino)propan-2-yl butyrate, (1-diethylamino-3-phenylmethoxy-propan-2-yl) Butanoate, [1-(diethylamino)-3-phenylmethoxypropan-2-yl] butanoate, 1-(BENZYLOXY)-3-(DIETHYLAMINO)PROPAN-2-YL BUTANOATE
| Molecular Formula | C18H29NO3 |
|---|---|
| Molecular Weight | 307.21 g/mol |
| LogP | 3.2569 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 307.21475 |
| Heavy Atoms | 22 |
| Complexity | 404.0531 |
Chemical Identifiers
| CAS Number | 372085-31-9 |
|---|---|
| SMILES | CCCC(=O)OC(CN(CC)CC)COCC1=CC=CC=C1 |
Product Overview
1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate (CAS 372085-31-9), with molecular formula C18H29NO3 and molecular weight 307.21 g/mol. IUPAC: [1-(diethylamino)-3-phenylmethoxypropan-2-yl] butanoate.
Chemical Property Profile of 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate
Property Insights of 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate
The XLogP value of 3.2569 indicates that 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate has 0 hydrogen bond donor(s) and 4 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 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate?
The CAS number of 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate is 372085-31-9.
What is the molecular formula of 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate?
The molecular formula of 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate is C18H29NO3.
What is the molecular weight of 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate?
The molecular weight of 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate is 307.21 g/mol.
Where can I buy 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate?
You can request a quote for 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzyloxy)-3-(diethylamino)propan-2-YL butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.