EINECS 260-989-1
TL;DR: EINECS 260-989-1 (CAS 57849-64-6) is a chemical compound with molecular formula C15H28N2O8S and molecular weight 396.15665 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(2-methylsulfonylethoxycarbonylamino)hexanoic acid
Also Known As: 1,4-dimethyl-2-phenoxy-1,4,2-diazaphospholidine-2,5-dione, n2-(tert-butoxycarbonyl)-n6-{[2-(methylsulfonyl)ethoxy]carbonyl}lysine, N2-((1,1-Dimethylethoxy)carbonyl)-N6-((2-(methylsulphonyl)ethoxy)carbonyl)-L-lysine, N2-[(1,1-DIMETHYLETHOXY)CARBONYL]-N6-[[2-(METHYLSULFONYL)ETHOXY]CARBONYL]-L-LYSINE, (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(2-methylsulfonylethoxycarbonylamino)hexanoic acid
Technical Specifications
| Molecular Formula | C15H28N2O8S |
| Molecular Weight | 396.15665 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 156.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 396.15665 Da |
| Heavy Atoms | 26 |
| Complexity | 577.0 |
| SMILES | CC(C)(C)OC(=O)NC(CCCCNC(=O)OCCS(=O)(=O)C)C(=O)O |
| InChIKey | RLQDBNNHPULZNU-UHFFFAOYSA-N |
Chemical Property Profile of EINECS 260-989-1
Property Insights of EINECS 260-989-1
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 260-989-1. The TPSA of 156.0 Ų indicates high polarity, suggesting EINECS 260-989-1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 260-989-1 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of EINECS 260-989-1?
The CAS number of EINECS 260-989-1 is 57849-64-6.
What is the molecular formula of EINECS 260-989-1?
The molecular formula of EINECS 260-989-1 is C15H28N2O8S.
What is the molecular weight of EINECS 260-989-1?
The molecular weight of EINECS 260-989-1 is 396.15665 g/mol.
Where can I buy EINECS 260-989-1?
You can request a quote for EINECS 260-989-1 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for EINECS 260-989-1?
Yes, CoreyChem provides custom synthesis services for EINECS 260-989-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.