![[(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate structure](/static/products/852/852296-49-2.png)
[(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate
TL;DR: [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate (CAS 852296-49-2) is a chemical compound with molecular formula C20H22N2O5S and molecular weight 402.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(propan-2-ylamino)ethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]benzoate
Also Known As: [(propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate|[2-oxo-2-(propan-2-ylamino)ethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]benzoate|MLS000394188|SMR000248591|EN300-26588866
| Molecular Formula | C20H22N2O5S |
|---|---|
| Molecular Weight | 402.12 g/mol |
| LogP | 2.7806 |
| Topological Polar Surface Area | 101.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 402.12494 |
| Heavy Atoms | 28 |
| Complexity | 953.57117 |
Chemical Identifiers
| CAS Number | 852296-49-2 |
|---|---|
| SMILES | CC(C)NC(=O)COC(=O)C1=CC(=CC=C1)NS(=O)(=O)/C=C/C2=CC=CC=C2 |
Product Overview
[(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate (CAS 852296-49-2), with molecular formula C20H22N2O5S and molecular weight 402.12 g/mol. IUPAC: [2-oxo-2-(propan-2-ylamino)ethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]benzoate.
Chemical Property Profile of [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate
Property Insights of [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate
The XLogP value of 2.7806 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate. The TPSA of 101.57 Ų falls within the moderate polarity range, balancing permeability and solubility for [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate. Following Lipinski's Rule of Five, [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate has 2 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 [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate?
The CAS number of [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate is 852296-49-2.
What is the molecular formula of [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate?
The molecular formula of [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate is C20H22N2O5S.
What is the molecular weight of [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate?
The molecular weight of [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate is 402.12 g/mol.
Where can I buy [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate?
You can request a quote for [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for [(Propan-2-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.