3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime
TL;DR: 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime (CAS 351368-96-2) is a chemical compound with molecular formula C18H15N3O7 and molecular weight 385.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(7-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)amino] 3,5-dinitrobenzoate
Also Known As: 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime, (3,5-Dinitrophenyl){[(7-methoxy-3,4-dihydronaphthalen-1(2H)-ylidene)amino]oxy}methanone, [(7-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)amino] 3,5-dinitrobenzoate
| Molecular Formula | C18H15N3O7 |
|---|---|
| Molecular Weight | 385.09 g/mol |
| LogP | 3.409 |
| Topological Polar Surface Area | 134.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 385.091 |
| Heavy Atoms | 28 |
| Complexity | 968.4189 |
Chemical Identifiers
| CAS Number | 351368-96-2 |
|---|---|
| SMILES | COC1=CC2=C(CCCC2=NOC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C=C1 |
Product Overview
3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime (CAS 351368-96-2), with molecular formula C18H15N3O7 and molecular weight 385.09 g/mol. IUPAC: [(7-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)amino] 3,5-dinitrobenzoate.
Chemical Property Profile of 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime
Property Insights of 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime
The XLogP value of 3.409 indicates that 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime. Following Lipinski's Rule of Five, 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime?
The CAS number of 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime is 351368-96-2.
What is the molecular formula of 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime?
The molecular formula of 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime is C18H15N3O7.
What is the molecular weight of 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime?
The molecular weight of 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime is 385.09 g/mol.
Where can I buy 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime?
You can request a quote for 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone O-(3,5-dinitrobenzoyl)oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.