C42H42N4O6
TL;DR: C42H42N4O6 (CAS 104712-07-4) is a chemical compound with molecular formula C42H42N4O6 and molecular weight 698.3104 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyl-8-[(5-methyl-2-pyridinyl)iminomethyl]-5-propan-2-yl-2-[1,6,7-trihydroxy-3-methyl-8-[(5-methyl-2-pyridinyl)iminomethyl]-5-propan-2-ylnaphthalen-2-yl]naphthalene-1,6,7-triol
Technical Specifications
| Molecular Formula | C42H42N4O6 |
| Molecular Weight | 698.3104 g/mol |
| XLogP | 8.8 |
| Topological Polar Surface Area (TPSA) | 172.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 698.3104 Da |
| Heavy Atoms | 52 |
| Complexity | 1140.0 |
| SMILES | CC1=CN=C(C=C1)N=CC2=C(C(=C(C3=C2C(=C(C(=C3)C)C4=C(C5=C(C=C4C)C(=C(C(=C5C=NC6=NC=C(C=C6)C)O)O)C(C)C)O)O)C(C)C)O)O |
| InChIKey | HEROADPROLMKRK-UHFFFAOYSA-N |
Chemical Property Profile of C42H42N4O6
Property Insights of C42H42N4O6
The XLogP value of 8.8 indicates that C42H42N4O6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 172.0 Ų indicates high polarity, suggesting C42H42N4O6 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C42H42N4O6 has 6 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 C42H42N4O6?
The CAS number of C42H42N4O6 is 104712-07-4.
What is the molecular formula of C42H42N4O6?
The molecular formula of C42H42N4O6 is C42H42N4O6.
What is the molecular weight of C42H42N4O6?
The molecular weight of C42H42N4O6 is 698.3104 g/mol.
Where can I buy C42H42N4O6?
You can request a quote for C42H42N4O6 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C42H42N4O6?
Yes, CoreyChem provides custom synthesis services for C42H42N4O6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.