Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate
TL;DR: Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate (CAS 315671-13-7) is a chemical compound with molecular formula C16H17NO3 and molecular weight 271.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate
Also Known As: ethyl 4-(1-naphthylamino)-4-oxobutanoate, ethyl 3-(N-naphthylcarbamoyl)propanoate, ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate
| Molecular Formula | C16H17NO3 |
|---|---|
| Molecular Weight | 271.12 g/mol |
| LogP | 3.1216 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 271.12085 |
| Heavy Atoms | 20 |
| Complexity | 616.653 |
Chemical Identifiers
| CAS Number | 315671-13-7 |
|---|---|
| SMILES | CCOC(=O)CCC(=O)NC1=CC=CC2=CC=CC=C21 |
Product Overview
Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate (CAS 315671-13-7), with molecular formula C16H17NO3 and molecular weight 271.12 g/mol. IUPAC: ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate.
Chemical Property Profile of Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate
Property Insights of Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate
The XLogP value of 3.1216 indicates that Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate has 1 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 Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate?
The CAS number of Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate is 315671-13-7.
What is the molecular formula of Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate?
The molecular formula of Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate is C16H17NO3.
What is the molecular weight of Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate?
The molecular weight of Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate is 271.12 g/mol.
Where can I buy Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate?
You can request a quote for Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(naphthalen-1-ylamino)-4-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.