Dimethyl 5-(2-naphthoylamino)isophthalate
TL;DR: Dimethyl 5-(2-naphthoylamino)isophthalate (CAS 425416-49-5) is a chemical compound with molecular formula C21H17NO5 and molecular weight 363.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-(naphthalene-2-carbonylamino)benzene-1,3-dicarboxylate
Also Known As: dimethyl 5-(2-naphthoylamino)isophthalate, dimethyl 5-(2-naphthamido)isophthalate, BIM-0008119.P001, AB00103406-01, AO-548/14964326
| Molecular Formula | C21H17NO5 |
|---|---|
| Molecular Weight | 363.11 g/mol |
| LogP | 3.6653 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.1107 |
| Heavy Atoms | 27 |
| Complexity | 1007.42633 |
Chemical Identifiers
| CAS Number | 425416-49-5 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC3=CC=CC=C3C=C2)C(=O)OC |
Product Overview
Dimethyl 5-(2-naphthoylamino)isophthalate (CAS 425416-49-5), with molecular formula C21H17NO5 and molecular weight 363.11 g/mol. IUPAC: dimethyl 5-(naphthalene-2-carbonylamino)benzene-1,3-dicarboxylate.
Chemical Property Profile of Dimethyl 5-(2-naphthoylamino)isophthalate
Property Insights of Dimethyl 5-(2-naphthoylamino)isophthalate
The XLogP value of 3.6653 indicates that Dimethyl 5-(2-naphthoylamino)isophthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 5-(2-naphthoylamino)isophthalate. Following Lipinski's Rule of Five, Dimethyl 5-(2-naphthoylamino)isophthalate 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 5-(2-naphthoylamino)isophthalate?
The CAS number of Dimethyl 5-(2-naphthoylamino)isophthalate is 425416-49-5.
What is the molecular formula of Dimethyl 5-(2-naphthoylamino)isophthalate?
The molecular formula of Dimethyl 5-(2-naphthoylamino)isophthalate is C21H17NO5.
What is the molecular weight of Dimethyl 5-(2-naphthoylamino)isophthalate?
The molecular weight of Dimethyl 5-(2-naphthoylamino)isophthalate is 363.11 g/mol.
Where can I buy Dimethyl 5-(2-naphthoylamino)isophthalate?
You can request a quote for Dimethyl 5-(2-naphthoylamino)isophthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 5-(2-naphthoylamino)isophthalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 5-(2-naphthoylamino)isophthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.