AO-081/15045279
TL;DR: AO-081/15045279 (CAS 6340-01-8) is a chemical compound with molecular formula C19H18N2O3S and molecular weight 354.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-ethoxynaphthalen-1-yl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: AO-081/15045279, 5-[(4-ethoxynaphthalen-1-yl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-[(4-ethoxy-1-naphthyl)methylene]-1,3-dimethyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
| Molecular Formula | C19H18N2O3S |
|---|---|
| Molecular Weight | 354.10 g/mol |
| LogP | 2.8372 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.10382 |
| Heavy Atoms | 25 |
| Complexity | 894.0252 |
Chemical Identifiers
| CAS Number | 6340-01-8 |
|---|---|
| SMILES | CCOC1=CC=C(C2=CC=CC=C21)C=C3C(=O)N(C(=S)N(C3=O)C)C |
Product Overview
AO-081/15045279 (CAS 6340-01-8), with molecular formula C19H18N2O3S and molecular weight 354.10 g/mol. IUPAC: 5-[(4-ethoxynaphthalen-1-yl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of AO-081/15045279
Property Insights of AO-081/15045279
The XLogP value of 2.8372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-081/15045279. With a topological polar surface area (TPSA) of 49.85 Ų, AO-081/15045279 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-081/15045279 has 0 hydrogen bond donor(s) and 4 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 AO-081/15045279?
The CAS number of AO-081/15045279 is 6340-01-8.
What is the molecular formula of AO-081/15045279?
The molecular formula of AO-081/15045279 is C19H18N2O3S.
What is the molecular weight of AO-081/15045279?
The molecular weight of AO-081/15045279 is 354.10 g/mol.
Where can I buy AO-081/15045279?
You can request a quote for AO-081/15045279 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/15045279?
Yes, KEHONG BIO provides custom synthesis services for AO-081/15045279 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.