15-Methoxyansamitocin P-3
TL;DR: 15-Methoxyansamitocin P-3 (CAS 117860-08-9) is a chemical compound with molecular formula C33H45ClN2O10 and molecular weight 664.27625 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(11-chloro-21-hydroxy-12,15,20-trimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl) 2-methylpropanoate
Also Known As: 15-Methoxyansamitocin P-3, [(1S,2R,3S,5S,6S,16E,18E,20R,21S)-11-chloro-21-hydroxy-12,15,20-trimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl] 2-methylpropanoate
Technical Specifications
| Molecular Formula | C33H45ClN2O10 |
| Molecular Weight | 664.27625 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 145.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 664.27625 Da |
| Heavy Atoms | 46 |
| Complexity | 1200.0 |
| SMILES | CC1C2CC(C(C=CC=C(C(C3=CC(=C(C(=C3)OC)Cl)N(C(=O)CC(C4(C1O4)C)OC(=O)C(C)C)C)OC)C)OC)(NC(=O)O2)O |
| InChIKey | HCVXCBYLIZAAEV-UHFFFAOYSA-N |
Chemical Property Profile of 15-Methoxyansamitocin P-3
Property Insights of 15-Methoxyansamitocin P-3
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 15-Methoxyansamitocin P-3. The TPSA of 145.0 Ų indicates high polarity, suggesting 15-Methoxyansamitocin P-3 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 15-Methoxyansamitocin P-3 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 15-Methoxyansamitocin P-3?
The CAS number of 15-Methoxyansamitocin P-3 is 117860-08-9.
What is the molecular formula of 15-Methoxyansamitocin P-3?
The molecular formula of 15-Methoxyansamitocin P-3 is C33H45ClN2O10.
What is the molecular weight of 15-Methoxyansamitocin P-3?
The molecular weight of 15-Methoxyansamitocin P-3 is 664.27625 g/mol.
Where can I buy 15-Methoxyansamitocin P-3?
You can request a quote for 15-Methoxyansamitocin P-3 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 15-Methoxyansamitocin P-3?
Yes, CoreyChem provides custom synthesis services for 15-Methoxyansamitocin P-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.