1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate
TL;DR: 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate (CAS 1185373-79-8) is a chemical compound with molecular formula C23H23N3O8S and molecular weight 501.12057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(naphthalen-1-ylmethyl)-4-(2-nitrophenyl)sulfonylpiperazine;oxalic acid
Also Known As: 1-(naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate, 1-(naphthalen-1-ylmethyl)-4-(2-nitrophenyl)sulfonylpiperazine; oxalic acid, IUPAC: 1-(naphthalen-1-ylmethyl)-4-(2-nitrophenyl)sulfonyl-piperazine; Oxalic Acid
Technical Specifications
| Molecular Formula | C23H23N3O8S |
| Molecular Weight | 501.12057 g/mol |
| XLogP | 2.4101 |
| Topological Polar Surface Area (TPSA) | 169.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 501.12057 Da |
| Heavy Atoms | 35 |
| Complexity | 738.0 |
| SMILES | C1CN(CCN1CC2=CC=CC3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-].C(=O)(C(=O)O)O |
| InChIKey | MHWAFPCFLDSLKZ-UHFFFAOYSA-N |
Chemical Property Profile of 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate
Property Insights of 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate
The XLogP value of 2.4101 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate. The TPSA of 169.0 Ų indicates high polarity, suggesting 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate?
The CAS number of 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate is 1185373-79-8.
What is the molecular formula of 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate?
The molecular formula of 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate is C23H23N3O8S.
What is the molecular weight of 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate?
The molecular weight of 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate is 501.12057 g/mol.
Where can I buy 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate?
You can request a quote for 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate?
Yes, CoreyChem provides custom synthesis services for 1-(Naphthalen-1-ylmethyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.