Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate
TL;DR: Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate (CAS 56983-64-3) is a chemical compound with molecular formula C16H15NO4 and molecular weight 285.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate
Also Known As: dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate, dimethyl (E)-2-(naphthalen-1-ylamino)but-2-enedioate
| Molecular Formula | C16H15NO4 |
|---|---|
| Molecular Weight | 285.10 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.1001 |
| Heavy Atoms | 21 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 56983-64-3 |
|---|---|
| SMILES | COC(=O)C=C(C(=O)OC)NC1=CC=CC2=CC=CC=C21 |
| InChIKey | ZZWPMWHEHQYQTR-UHFFFAOYSA-N |
Product Overview
Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate (CAS 56983-64-3), with molecular formula C16H15NO4 and molecular weight 285.10 g/mol. IUPAC: dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate.
Chemical Property Profile of Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate
Property Insights of Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate
The XLogP value of 3.8 indicates that Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate. Following Lipinski's Rule of Five, Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate has 1 hydrogen bond donor(s) and 5 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 Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate?
The CAS number of Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate is 56983-64-3.
What is the molecular formula of Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate?
The molecular formula of Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate is C16H15NO4.
What is the molecular weight of Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate?
The molecular weight of Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate is 285.10 g/mol.
Where can I buy Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate?
You can request a quote for Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2-(naphthalen-1-ylamino)but-2-enedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.