Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate
TL;DR: Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate (CAS 161388-94-9) is a chemical compound with molecular formula C11H14N2O5S and molecular weight 286.06235 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-oxo-4-(4-sulfamoylanilino)butanoate
Also Known As: Maybridge1_002048, CBKinase1_000188, CBKinase1_012588, methyl 4-oxo-4-(4-sulfamoylanilino)butanoate, BAS 00530955
Technical Specifications
| Molecular Formula | C11H14N2O5S |
| Molecular Weight | 286.06235 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 286.06235 Da |
| Heavy Atoms | 19 |
| Complexity | 421.0 |
| SMILES | COC(=O)CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N |
| InChIKey | MTKQNEFREWGOAG-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate
Property Insights of Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate
The XLogP value of -0.2 indicates that Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate. Following Lipinski's Rule of Five, Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate?
The CAS number of Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate is 161388-94-9.
What is the molecular formula of Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate?
The molecular formula of Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate is C11H14N2O5S.
What is the molecular weight of Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate?
The molecular weight of Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate is 286.06235 g/mol.
Where can I buy Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate?
You can request a quote for Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-oxo-4-(4-sulfamoylanilino)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.