(1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me
TL;DR: (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me (CAS 5422-60-6) is a chemical compound with molecular formula C40H52N2O6 and molecular weight 656.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-8-(pentyliminomethyl)-5-propan-2-yl-2-[1,6,7-trihydroxy-3-methyl-8-(pentyliminomethyl)-5-propan-2-ylnaphthalen-2-yl]naphthalene-1,6,7-triol
Also Known As: (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me, (8E,8'E)-1,1',6,6'-Tetrahydroxy-3,3'-dimethyl-8,8'-bis[(pentylamino)methylidene]-5,5'-di(propan-2-yl)[2,2'-binaphthalene]-7,7'(8H,8'H)-dione, 3-Methyl-8-(pentyliminomethyl)-5-propan-2-yl-2-[1,6,7-trihydroxy-3-methyl-8-(pentyliminomethyl)-5-propan-2-ylnaphthalen-2-yl]naphthalene-1,6,7-triol, 7-[1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)methylidene]-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-1-[(pentylamino)methylidene]-4-propan-2-ylnaphthalen-2-one
| Molecular Formula | C40H52N2O6 |
|---|---|
| Molecular Weight | 656.38 g/mol |
| LogP | 9.6 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 656.3825 |
| Heavy Atoms | 48 |
| Complexity | 957.0 |
Chemical Identifiers
| CAS Number | 5422-60-6 |
|---|---|
| SMILES | CCCCCN=CC1=C(C(=C(C2=C1C(=C(C(=C2)C)C3=C(C4=C(C=C3C)C(=C(C(=C4C=NCCCCC)O)O)C(C)C)O)O)C(C)C)O)O |
| InChIKey | BBVAWKRITDKJPY-UHFFFAOYSA-N |
Product Overview
(1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me (CAS 5422-60-6), with molecular formula C40H52N2O6 and molecular weight 656.38 g/mol. IUPAC: 3-methyl-8-(pentyliminomethyl)-5-propan-2-yl-2-[1,6,7-trihydroxy-3-methyl-8-(pentyliminomethyl)-5-propan-2-ylnaphthalen-2-yl]naphthalene-1,6,7-triol.
Chemical Property Profile of (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me
Property Insights of (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me
The XLogP value of 9.6 indicates that (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.0 Ų indicates high polarity, suggesting (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me?
The CAS number of (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me is 5422-60-6.
What is the molecular formula of (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me?
The molecular formula of (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me is C40H52N2O6.
What is the molecular weight of (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me?
The molecular weight of (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me is 656.38 g/mol.
Where can I buy (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me?
You can request a quote for (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me?
Yes, KEHONG BIO provides custom synthesis services for (1E)-7-[(8E)-1,6-dihydroxy-3-methyl-7-oxo-8-[(pentylamino)me and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.