Valspodar
TL;DR: Valspodar (CAS 121584-18-7) is a chemical compound with molecular formula C63H111N11O12 and molecular weight 1213.8413 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-1,4,7,10,12,15,19,25,28-nonamethyl-33-[(2R)-2-methylhex-4-enoyl]-6,9,18,24-tetrakis(2-methylpropyl)-3,21,30-tri(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacontane-2,5,8,11,14,17,20,23,26,29,32-undecone
Also Known As: Valspodar
Technical Specifications
| Molecular Formula | C63H111N11O12 |
| Molecular Weight | 1213.8413 g/mol |
| XLogP | 7.7 |
| Topological Polar Surface Area (TPSA) | 276.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 15 |
| Exact Mass | 1213.8413 Da |
| Heavy Atoms | 86 |
| Complexity | 2410.0 |
| SMILES | CC=CC[C@@H](C)C(=O)[C@H]1C(=O)N[C@H](C(=O)N(CC(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C)C(C)C |
| InChIKey | YJDYDFNKCBANTM-VOGZYGFXSA-N |
Chemical Property Profile of Valspodar
Property Insights of Valspodar
The XLogP value of 7.7 indicates that Valspodar is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 276.0 Ų indicates high polarity, suggesting Valspodar may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Valspodar has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Valspodar?
The CAS number of Valspodar is 121584-18-7.
What is the molecular formula of Valspodar?
The molecular formula of Valspodar is C63H111N11O12.
What is the molecular weight of Valspodar?
The molecular weight of Valspodar is 1213.8413 g/mol.
Where can I buy Valspodar?
You can request a quote for Valspodar directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Valspodar?
Yes, CoreyChem provides custom synthesis services for Valspodar and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.