1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate
TL;DR: 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate (CAS 130155-86-1) 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.
4-O-(2-carbamoylphenyl) 1-O-ethyl butanedioate
Also Known As: Salicylamide hemisuccinate ethyl ester, 2-Carbamoylphenyl ethyl butanedioate, 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate, (2-carbamoylphenyl) Ethyl Butanedioate, 4-O-(2-carbamoylphenyl) 1-O-ethyl butanedioate
| Molecular Formula | C13H15NO5 |
|---|---|
| Molecular Weight | 265.10 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 95.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 265.09503 |
| Heavy Atoms | 19 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 130155-86-1 |
|---|---|
| SMILES | CCOC(=O)CCC(=O)OC1=CC=CC=C1C(=O)N |
| InChIKey | HVQXDWUWXNHOMN-UHFFFAOYSA-N |
Product Overview
1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate (CAS 130155-86-1), with molecular formula C13H15NO5 and molecular weight 265.10 g/mol. IUPAC: 4-O-(2-carbamoylphenyl) 1-O-ethyl butanedioate.
Chemical Property Profile of 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate
Property Insights of 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate. Following Lipinski's Rule of Five, 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate 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 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate?
The CAS number of 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate is 130155-86-1.
What is the molecular formula of 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate?
The molecular formula of 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate is C13H15NO5.
What is the molecular weight of 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate?
The molecular weight of 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate is 265.10 g/mol.
Where can I buy 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate?
You can request a quote for 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate?
Yes, KEHONG BIO provides custom synthesis services for 1-O-(2-Carbamoylphenyl) 4-O-ethyl butanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.