Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate
TL;DR: Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate (CAS 5633-73-8) is a chemical compound with molecular formula C22H19N3O7S and molecular weight 469.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(N-(2-nitrophenyl)sulfonylanilino)acetyl]amino]benzoate
Also Known As: 2,4-dimethoxy-1-methylsulfanyl-benzene, BAS 00550763, BIM-0009575.P001, METHYL 2-[[2-[(2-NITROPHENYL)SULFONYL-PHENYL-AMINO]ACETYL]AMINO]BENZOATE, methyl 2-[[2-(N-(2-nitrophenyl)sulfonylanilino)acetyl]amino]benzoate
| Molecular Formula | C22H19N3O7S |
|---|---|
| Molecular Weight | 469.09 g/mol |
| LogP | 3.2154 |
| Topological Polar Surface Area | 135.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 469.09436 |
| Heavy Atoms | 33 |
| Complexity | 1294.1063 |
Chemical Identifiers
| CAS Number | 5633-73-8 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-] |
Product Overview
Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate (CAS 5633-73-8), with molecular formula C22H19N3O7S and molecular weight 469.09 g/mol. IUPAC: methyl 2-[[2-(N-(2-nitrophenyl)sulfonylanilino)acetyl]amino]benzoate.
Chemical Property Profile of Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate
Property Insights of Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate
The XLogP value of 3.2154 indicates that Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.92 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate. Following Lipinski's Rule of Five, Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate has 1 hydrogen bond donor(s) and 7 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 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate?
The CAS number of Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate is 5633-73-8.
What is the molecular formula of Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate?
The molecular formula of Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate is C22H19N3O7S.
What is the molecular weight of Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate?
The molecular weight of Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate is 469.09 g/mol.
Where can I buy Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate?
You can request a quote for Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[[2-[(2-nitrophenyl)sulfonyl-phenyl-amino]acetyl]amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.