EINECS 261-304-9
TL;DR: EINECS 261-304-9 (CAS 58517-90-1) is a chemical compound with molecular formula C35H56N4O7S and molecular weight 676.38696 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-[1-[2-hexadecoxy-5-(methylsulfamoyl)anilino]-4,4-dimethyl-1,3-dioxopentan-2-yl]imidazole-4-carboxylate
Also Known As: Methyl 1-(1-(((2-(hexadecyloxy)-5-((methylamino)sulphonyl)phenyl)amino)carbonyl)-3,3-dimethyl-2-oxobutyl)-1H-imidazole-5-carboxylate, methyl 1-(1-{[2-(hexadecyloxy)-5-(methylsulfamoyl)phenyl]amino}-4,4-dimethyl-1,3-dioxopentan-2-yl)-1h-imidazole-5-carboxylate, methyl 3-[1-[2-hexadecoxy-5-(methylsulfamoyl)anilino]-4,4-dimethyl-1,3-dioxopentan-2-yl]imidazole-4-carboxylate, 1-[1-[[[2-(Hexadecyloxy)-5-[(methylamino)sulfonyl]phenyl]amino]carbonyl]-3,3-dimethyl-2-oxobutyl]-1H-imidazole-5-carboxylic acid methyl ester, 1H-Imidazole-5-carboxylicacid,1-[1-[[[2-(hexadecyloxy)-5-[(methylamino)sulfonyl]phenyl]amino]carbonyl]-3,3-dimethyl-2-oxobutyl]-,methyl ester
Technical Specifications
| Molecular Formula | C35H56N4O7S |
| Molecular Weight | 676.38696 g/mol |
| XLogP | 9.8 |
| Topological Polar Surface Area (TPSA) | 154.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 25 |
| Exact Mass | 676.38696 Da |
| Heavy Atoms | 47 |
| Complexity | 1040.0 |
| SMILES | CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)S(=O)(=O)NC)NC(=O)C(C(=O)C(C)(C)C)N2C=NC=C2C(=O)OC |
| InChIKey | GIFUEPRVNOQDJA-UHFFFAOYSA-N |
Chemical Property Profile of EINECS 261-304-9
Property Insights of EINECS 261-304-9
The XLogP value of 9.8 indicates that EINECS 261-304-9 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 154.0 Ų indicates high polarity, suggesting EINECS 261-304-9 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 261-304-9 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of EINECS 261-304-9?
The CAS number of EINECS 261-304-9 is 58517-90-1.
What is the molecular formula of EINECS 261-304-9?
The molecular formula of EINECS 261-304-9 is C35H56N4O7S.
What is the molecular weight of EINECS 261-304-9?
The molecular weight of EINECS 261-304-9 is 676.38696 g/mol.
Where can I buy EINECS 261-304-9?
You can request a quote for EINECS 261-304-9 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for EINECS 261-304-9?
Yes, CoreyChem provides custom synthesis services for EINECS 261-304-9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.