![methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate structure](/static/products/1089/1089293-23-1.webp)
methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate
TL;DR: methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate (CAS 1089293-23-1) is a chemical compound with molecular formula C12H13NO5S and molecular weight 283.05145 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (E)-3-(4-acetamidophenyl)sulfonylprop-2-enoate
Also Known As: AB00116124-01, (E)-methyl 3-((4-acetamidophenyl)sulfonyl)acrylate, BRD-K69320401-001-01-8, methyl (E)-3-(4-acetamidophenyl)sulfonylprop-2-enoate, methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate
Technical Specifications
| Molecular Formula | C12H13NO5S |
| Molecular Weight | 283.05145 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 97.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 283.05145 Da |
| Heavy Atoms | 19 |
| Complexity | 455.0 |
| SMILES | CC(=O)NC1=CC=C(C=C1)S(=O)(=O)/C=C/C(=O)OC |
| InChIKey | JGXNFHZQGMXIMT-BQYQJAHWSA-N |
Chemical Property Profile of methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate
Property Insights of methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate. The TPSA of 97.9 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate. Following Lipinski's Rule of Five, methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate 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
What is the CAS number of methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate?
The CAS number of methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate is 1089293-23-1.
What is the molecular formula of methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate?
The molecular formula of methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate is C12H13NO5S.
What is the molecular weight of methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate?
The molecular weight of methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate is 283.05145 g/mol.
Where can I buy methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate?
You can request a quote for methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate?
Yes, CoreyChem provides custom synthesis services for methyl (2E)-3-{[4-(acetylamino)phenyl]sulfonyl}prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.