(1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one
TL;DR: (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one (CAS 374701-82-3) is a chemical compound with molecular formula C50H56N2O8 and molecular weight 812.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one
Also Known As: (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one, (8Z,8'Z)-8,8'-bis(((4-butoxyphenyl)amino)methylene)-1,1',6,6'-tetrahydroxy-5,5'-diisopropyl-3,3'-dimethyl-[2,2'-binaphthalene]-7,7'(8H,8'H)-dione, (8Z,8'Z)-8,8'-bis{[(4-butoxyphenyl)amino]methylidene}-1,1',6,6'-tetrahydroxy-3,3'-dimethyl-5,5'-di(propan-2-yl)-2,2'-binaphthalene-7,7'(8H,8'H)-dione
| Molecular Formula | C50H56N2O8 |
|---|---|
| Molecular Weight | 812.40 g/mol |
| LogP | 11.66104 |
| Topological Polar Surface Area | 157.58 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 15 |
| Exact Mass | 812.4037 |
| Heavy Atoms | 60 |
| Complexity | 2262.6172 |
Chemical Identifiers
| CAS Number | 374701-82-3 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)N/C=C/2\C(=O)C(=C(C3=C2C(=C(C(=C3)C)C4=C(C\5=C(C(=C(C(=O)/C5=C\NC6=CC=C(C=C6)OCCCC)O)C(C)C)C=C4C)O)O)C(C)C)O |
Product Overview
(1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one (CAS 374701-82-3), with molecular formula C50H56N2O8 and molecular weight 812.40 g/mol. IUPAC: (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one.
Chemical Property Profile of (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one
Property Insights of (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one
The XLogP value of 11.66104 indicates that (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 157.58 Ų indicates high polarity, suggesting (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one?
The CAS number of (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one is 374701-82-3.
What is the molecular formula of (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one?
The molecular formula of (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one is C50H56N2O8.
What is the molecular weight of (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one?
The molecular weight of (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one is 812.40 g/mol.
Where can I buy (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one?
You can request a quote for (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one?
Yes, KEHONG BIO provides custom synthesis services for (1Z)-1-[(4-butoxyanilino)methylidene]-7-[(8Z)-8-[(4-butoxyanilino)methylidene]-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.