Butyl 4-(methanesulfonamido)benzoate
TL;DR: Butyl 4-(methanesulfonamido)benzoate (CAS 301308-92-9) is a chemical compound with molecular formula C12H17NO4S and molecular weight 271.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 4-(methanesulfonamido)benzoate
Also Known As: butyl 4-(methanesulfonamido)benzoate, butyl 4-[(methylsulfonyl)amino]benzoate, BUTYL 4-METHANESULFONAMIDOBENZOATE, BAS 00376649, 4-Methanesulfonylamino-benzoic acid butyl ester
| Molecular Formula | C12H17NO4S |
|---|---|
| Molecular Weight | 271.09 g/mol |
| LogP | 2.015 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.08783 |
| Heavy Atoms | 18 |
| Complexity | 493.31363 |
Chemical Identifiers
| CAS Number | 301308-92-9 |
|---|---|
| SMILES | CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C |
Product Overview
Butyl 4-(methanesulfonamido)benzoate (CAS 301308-92-9), with molecular formula C12H17NO4S and molecular weight 271.09 g/mol. IUPAC: butyl 4-(methanesulfonamido)benzoate.
Chemical Property Profile of Butyl 4-(methanesulfonamido)benzoate
Property Insights of Butyl 4-(methanesulfonamido)benzoate
The XLogP value of 2.015 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl 4-(methanesulfonamido)benzoate. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl 4-(methanesulfonamido)benzoate. Following Lipinski's Rule of Five, Butyl 4-(methanesulfonamido)benzoate has 1 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 Butyl 4-(methanesulfonamido)benzoate?
The CAS number of Butyl 4-(methanesulfonamido)benzoate is 301308-92-9.
What is the molecular formula of Butyl 4-(methanesulfonamido)benzoate?
The molecular formula of Butyl 4-(methanesulfonamido)benzoate is C12H17NO4S.
What is the molecular weight of Butyl 4-(methanesulfonamido)benzoate?
The molecular weight of Butyl 4-(methanesulfonamido)benzoate is 271.09 g/mol.
Where can I buy Butyl 4-(methanesulfonamido)benzoate?
You can request a quote for Butyl 4-(methanesulfonamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 4-(methanesulfonamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 4-(methanesulfonamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.