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Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate
TL;DR: Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate (CAS 439108-87-9) is a chemical compound with molecular formula C21H18ClNO3 and molecular weight 367.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(3-chlorobenzoyl)amino]-3-naphthalen-1-ylpropanoate
Also Known As: MixCom2_000007, Bionet1_000004, methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate, methyl 3-[(3-chlorophenyl)formamido]-3-(naphthalen-1-yl)propanoate, 4T-0631
| Molecular Formula | C21H18ClNO3 |
|---|---|
| Molecular Weight | 367.10 g/mol |
| LogP | 4.5274 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 367.09753 |
| Heavy Atoms | 26 |
| Complexity | 949.39886 |
Chemical Identifiers
| CAS Number | 439108-87-9 |
|---|---|
| SMILES | COC(=O)CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=CC(=CC=C3)Cl |
Product Overview
Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate (CAS 439108-87-9), with molecular formula C21H18ClNO3 and molecular weight 367.10 g/mol. IUPAC: methyl 3-[(3-chlorobenzoyl)amino]-3-naphthalen-1-ylpropanoate.
Chemical Property Profile of Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate
Property Insights of Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate
The XLogP value of 4.5274 indicates that Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate 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 Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate?
The CAS number of Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate is 439108-87-9.
What is the molecular formula of Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate?
The molecular formula of Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate is C21H18ClNO3.
What is the molecular weight of Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate?
The molecular weight of Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate is 367.10 g/mol.
Where can I buy Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate?
You can request a quote for Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[(3-chlorobenzoyl)amino]-3-(1-naphthyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.