RefChem:1077365
TL;DR: RefChem:1077365 (CAS 148865-00-3) is a chemical compound with molecular formula C54H83NO17 and molecular weight 1017.5661 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[6-[6-[(10'E,14'E,16'E)-2-butan-2-yl-21',24'-dihydroxy-22'-(2-methoxyethoxymethoxymethyl)-3,11',13'-trimethyl-2'-oxospiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-12'-yl]oxy-4-methoxy-2-methyloxan-3-yl]oxy-4-methoxy-2-methyloxan-3-yl]acetamide
Also Known As: Avermectin A1a, 4''-(acetylamino)-5-O-demethyl-4''-deoxy-26-((2-methoxyethoxy)methoxy)-, (4''R)-
Technical Specifications
| Molecular Formula | C54H83NO17 |
| Molecular Weight | 1017.5661 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 207.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 16 |
| Exact Mass | 1017.5661 Da |
| Heavy Atoms | 72 |
| Complexity | 1970.0 |
| SMILES | CCC(C)C1C(C=CC2(O1)CC3CC(O2)C/C=C(/C(C(/C=C/C=C/4\COC5C4(C(C=C(C5O)COCOCCOC)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)NC(=O)C)OC)OC)\C)C |
| InChIKey | AJVUHKQJTHEJRA-NLGMDJEFSA-N |
Chemical Property Profile of RefChem:1077365
Property Insights of RefChem:1077365
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1077365. The TPSA of 207.0 Ų indicates high polarity, suggesting RefChem:1077365 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1077365 has 3 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1077365?
The CAS number of RefChem:1077365 is 148865-00-3.
What is the molecular formula of RefChem:1077365?
The molecular formula of RefChem:1077365 is C54H83NO17.
What is the molecular weight of RefChem:1077365?
The molecular weight of RefChem:1077365 is 1017.5661 g/mol.
Where can I buy RefChem:1077365?
You can request a quote for RefChem:1077365 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1077365?
Yes, CoreyChem provides custom synthesis services for RefChem:1077365 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.