PD 118576-A2
TL;DR: PD 118576-A2 (CAS 142386-68-3) is a chemical compound with molecular formula C37H56O12 and molecular weight 692.3772 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-4-[2,8-dihydroxy-9-[(4Z,6E,12E,14E)-10-hydroxy-3,15-dimethoxy-7,9,11,13-tetramethyl-16-oxo-1-oxacyclohexadeca-4,6,12,14-tetraen-2-yl]-3,7-dimethyl-6-oxodecan-4-yl]oxy-4-oxobut-2-enoic acid
Also Known As: PD 118576-A2, Hygrolidin, 19,23-deepoxy-23-deethyl-2-demethyl-23-hydroxy-2-methoxy-23-methyl-19-oxo-
Technical Specifications
| Molecular Formula | C37H56O12 |
| Molecular Weight | 692.3772 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 186.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 14 |
| Exact Mass | 692.3772 Da |
| Heavy Atoms | 49 |
| Complexity | 1280.0 |
| SMILES | CC1C/C(=C/C=C\C(C(OC(=O)/C(=C\C(=C\C(C1O)C)\C)/OC)C(C)C(C(C)C(=O)CC(C(C)C(C)O)OC(=O)/C=C/C(=O)O)O)OC)/C |
| InChIKey | VJPUXUDFGGBXQF-ZETKQQCDSA-N |
Chemical Property Profile of PD 118576-A2
Property Insights of PD 118576-A2
The XLogP value of 4.3 indicates that PD 118576-A2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 186.0 Ų indicates high polarity, suggesting PD 118576-A2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, PD 118576-A2 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 PD 118576-A2?
The CAS number of PD 118576-A2 is 142386-68-3.
What is the molecular formula of PD 118576-A2?
The molecular formula of PD 118576-A2 is C37H56O12.
What is the molecular weight of PD 118576-A2?
The molecular weight of PD 118576-A2 is 692.3772 g/mol.
Where can I buy PD 118576-A2?
You can request a quote for PD 118576-A2 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for PD 118576-A2?
Yes, CoreyChem provides custom synthesis services for PD 118576-A2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.