Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)-
TL;DR: Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)- (CAS 105441-18-7) is a chemical compound with molecular formula C12H11NO4S and molecular weight 265.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-oxothiolan-3-yl)carbamoyl]benzoic acid
Also Known As: 2-[(2-oxothiolan-3-yl)carbamoyl]benzoic acid, (+-)-2-(((2-Oxotetrahydro-3-thienyl)amino)carbonyl)benzoic acid, (+-)-2-((N-(Tetrahydro-2-oxo-3-thienyl)amino)carbonyl)benzoic acid, Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)-, 2-{Hydroxy[(2-oxothiolan-3-yl)imino]methyl}benzoic acid
| Molecular Formula | C12H11NO4S |
|---|---|
| Molecular Weight | 265.04 g/mol |
| LogP | 1.1467 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.0409 |
| Heavy Atoms | 18 |
| Complexity | 514.55383 |
Chemical Identifiers
| CAS Number | 105441-18-7 |
|---|---|
| SMILES | C1CSC(=O)C1NC(=O)C2=CC=CC=C2C(=O)O |
Product Overview
Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)- (CAS 105441-18-7), with molecular formula C12H11NO4S and molecular weight 265.04 g/mol. IUPAC: 2-[(2-oxothiolan-3-yl)carbamoyl]benzoic acid.
Chemical Property Profile of Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)-
Property Insights of Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)-
The XLogP value of 1.1467 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)-. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)-. Following Lipinski's Rule of Five, Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)- has 2 hydrogen bond donor(s) and 4 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 Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)-?
The CAS number of Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)- is 105441-18-7.
What is the molecular formula of Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)-?
The molecular formula of Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)- is C12H11NO4S.
What is the molecular weight of Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)-?
The molecular weight of Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)- is 265.04 g/mol.
Where can I buy Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)-?
You can request a quote for Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-(((2-oxotetrahydro-3-thienyl)amino)carbonyl)-, (+-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.