Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate
TL;DR: Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate (CAS 171863-89-1) is a chemical compound with molecular formula C15H15NO3 and molecular weight 257.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(naphthalen-1-ylamino)-4-oxobutanoate
Also Known As: Zinc,bromocyclopentyl, METHYL 3-(NAPHTHALEN-1-YLCARBAMOYL)PROPANOATE, methyl 4-(1-naphthylamino)-4-oxobutanoate, methyl 4-(naphthalen-1-ylamino)-4-oxobutanoate, methyl 3-(N-naphthylcarbamoyl)propanoate
| Molecular Formula | C15H15NO3 |
|---|---|
| Molecular Weight | 257.11 g/mol |
| LogP | 2.7315 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.1052 |
| Heavy Atoms | 19 |
| Complexity | 601.8671 |
Chemical Identifiers
| CAS Number | 171863-89-1 |
|---|---|
| SMILES | COC(=O)CCC(=O)NC1=CC=CC2=CC=CC=C21 |
Product Overview
Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate (CAS 171863-89-1), with molecular formula C15H15NO3 and molecular weight 257.11 g/mol. IUPAC: methyl 4-(naphthalen-1-ylamino)-4-oxobutanoate.
Chemical Property Profile of Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate
Property Insights of Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate
The XLogP value of 2.7315 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(naphthalen-1-ylcarbamoyl)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-(naphthalen-1-ylcarbamoyl)propanoate?
The CAS number of Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate is 171863-89-1.
What is the molecular formula of Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate?
The molecular formula of Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate is C15H15NO3.
What is the molecular weight of Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate?
The molecular weight of Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate is 257.11 g/mol.
Where can I buy Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate?
You can request a quote for Methyl 3-(naphthalen-1-ylcarbamoyl)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-(naphthalen-1-ylcarbamoyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(naphthalen-1-ylcarbamoyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.