Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate
TL;DR: Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate (CAS 303032-44-2) is a chemical compound with molecular formula C13H15NO5 and molecular weight 265.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate
Also Known As: dimethyl 2-propionamidoterephthalate, dimethyl 2-(propionylamino)terephthalate, BAS 01833501, 2-Propionylamino-terephthalic acid dimethyl ester, dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate
| Molecular Formula | C13H15NO5 |
|---|---|
| Molecular Weight | 265.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 265.09503 |
| Heavy Atoms | 19 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 303032-44-2 |
|---|---|
| SMILES | CCC(=O)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC |
| InChIKey | GPRMLEQARAQNLJ-UHFFFAOYSA-N |
Product Overview
Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate (CAS 303032-44-2), with molecular formula C13H15NO5 and molecular weight 265.10 g/mol. IUPAC: dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate.
Chemical Property Profile of Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate
Property Insights of Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate 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-(propanoylamino)benzene-1,4-dicarboxylate?
The CAS number of Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate is 303032-44-2.
What is the molecular formula of Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate?
The molecular formula of Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate is C13H15NO5.
What is the molecular weight of Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate?
The molecular weight of Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate is 265.10 g/mol.
Where can I buy Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate?
You can request a quote for Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2-(propanoylamino)benzene-1,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.