RefChem:1057775
TL;DR: RefChem:1057775 (CAS 100922-69-8) is a chemical compound with molecular formula C32H25NO11 and molecular weight 599.14276 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[12-hydroxy-9-[(Z)-3-hydroxy-3-(2-hydroxyphenyl)prop-2-enoyl]-10,11-dimethoxy-3-(methylcarbamoyl)-1-oxonaphtho[3,2-g]isochromen-8-yl]acetic acid
Also Known As: 1H-Anthra(2,3-c)pyran-8-acetic acid, 10,11-dimethoxy-12-hydroxy-9-(3-hydroxy-3-(2-hydroxyphenyl)-1-oxo-2-propenyl)-3-((methylamino)carbonyl)-1-oxo-, 2-[12-hydroxy-9-[(Z)-3-hydroxy-3-(2-hydroxyphenyl)prop-2-enoyl]-10,11-dimethoxy-3-(methylcarbamoyl)-1-oxonaphtho[3,2-g]isochromen-8-yl]acetic acid, 1H-Anthra(2,3-c)pyran-8-acetic acid,10,11-dimethoxy-12-hydroxy-9-(3-hydroxy-3-(2-hydroxyphenyl)-1-oxo-2-propenyl)-3-((methylamino)carbonyl)-1-oxo, BRN 5212007
Technical Specifications
| Molecular Formula | C32H25NO11 |
| Molecular Weight | 599.14276 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 189.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 599.14276 Da |
| Heavy Atoms | 44 |
| Complexity | 1200.0 |
| SMILES | CNC(=O)C1=CC2=CC3=CC4=CC(=C(C(=C4C(=C3C(=C2C(=O)O1)O)OC)OC)C(=O)/C=C(/C5=CC=CC=C5O)\O)CC(=O)O |
| InChIKey | MMIDNLBHEVZLTB-MOSHPQCFSA-N |
Chemical Property Profile of RefChem:1057775
Property Insights of RefChem:1057775
The XLogP value of 4.9 indicates that RefChem:1057775 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 189.0 Ų indicates high polarity, suggesting RefChem:1057775 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1057775 has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1057775?
The CAS number of RefChem:1057775 is 100922-69-8.
What is the molecular formula of RefChem:1057775?
The molecular formula of RefChem:1057775 is C32H25NO11.
What is the molecular weight of RefChem:1057775?
The molecular weight of RefChem:1057775 is 599.14276 g/mol.
Where can I buy RefChem:1057775?
You can request a quote for RefChem:1057775 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1057775?
Yes, CoreyChem provides custom synthesis services for RefChem:1057775 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.