![Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate structure](/static/products/879/879034-11-4.png)
Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate
TL;DR: Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate (CAS 879034-11-4) is a chemical compound with molecular formula C17H17NO5S and molecular weight 347.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[3-(benzenesulfonyl)propanoylamino]benzoate
Also Known As: methyl 4-(3-(phenylsulfonyl)propanamido)benzoate, methyl 4-[3-(benzenesulfonyl)propanoylamino]benzoate, methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate, methyl 4-{[3-(phenylsulfonyl)propanoyl]amino}benzoate, METHYL 4-[3-(BENZENESULFONYL)PROPANAMIDO]BENZOATE
| Molecular Formula | C17H17NO5S |
|---|---|
| Molecular Weight | 347.08 g/mol |
| LogP | 2.2757 |
| Topological Polar Surface Area | 89.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 347.08273 |
| Heavy Atoms | 24 |
| Complexity | 813.8192 |
Chemical Identifiers
| CAS Number | 879034-11-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NC(=O)CCS(=O)(=O)C2=CC=CC=C2 |
Product Overview
Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate (CAS 879034-11-4), with molecular formula C17H17NO5S and molecular weight 347.08 g/mol. IUPAC: methyl 4-[3-(benzenesulfonyl)propanoylamino]benzoate.
Chemical Property Profile of Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate
Property Insights of Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate
The XLogP value of 2.2757 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate. The TPSA of 89.54 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate. Following Lipinski's Rule of Five, Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate 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
Frequently Asked Questions
What is the CAS number of Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate?
The CAS number of Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate is 879034-11-4.
What is the molecular formula of Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate?
The molecular formula of Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate is C17H17NO5S.
What is the molecular weight of Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate?
The molecular weight of Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate is 347.08 g/mol.
Where can I buy Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate?
You can request a quote for Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.