A3565/0151258
TL;DR: A3565/0151258 (CAS 696607-26-8) is a chemical compound with molecular formula C18H20N4O5S and molecular weight 404.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-3-methyl-8'-nitro-2-sulfanylidenespiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-4,6-dione
Also Known As: A3565/0151258, 1'-ethyl-3'-methyl-8-nitro-2'-thioxo-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-4',6'(1'H,3'H)-dione, 1-ethyl-3-methyl-8'-nitro-2-sulfanylidenespiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-4,6-dione, Spiro[[1,4]oxazino[4,3-a]quinoline-5(6H),5a(2)(2a(2)H)-pyrimidine]-4a(2),6a(2)(1a(2)H,3a(2)H)-dione, 1a(2)-ethyl-1,2,4,4a-tetrahydro-3a(2)-methyl-8-nitro-2a(2)-thioxo-
| Molecular Formula | C18H20N4O5S |
|---|---|
| Molecular Weight | 404.12 g/mol |
| LogP | 0.9479 |
| Topological Polar Surface Area | 96.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 404.11545 |
| Heavy Atoms | 28 |
| Complexity | 905.9622 |
Chemical Identifiers
| CAS Number | 696607-26-8 |
|---|---|
| SMILES | CCN1C(=O)C2(CC3=C(C=CC(=C3)[N+](=O)[O-])N4C2COCC4)C(=O)N(C1=S)C |
Product Overview
A3565/0151258 (CAS 696607-26-8), with molecular formula C18H20N4O5S and molecular weight 404.12 g/mol. IUPAC: 1-ethyl-3-methyl-8'-nitro-2-sulfanylidenespiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-4,6-dione.
Chemical Property Profile of A3565/0151258
Property Insights of A3565/0151258
The XLogP value of 0.9479 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3565/0151258. The TPSA of 96.23 Ų falls within the moderate polarity range, balancing permeability and solubility for A3565/0151258. Following Lipinski's Rule of Five, A3565/0151258 has 0 hydrogen bond donor(s) and 7 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 A3565/0151258?
The CAS number of A3565/0151258 is 696607-26-8.
What is the molecular formula of A3565/0151258?
The molecular formula of A3565/0151258 is C18H20N4O5S.
What is the molecular weight of A3565/0151258?
The molecular weight of A3565/0151258 is 404.12 g/mol.
Where can I buy A3565/0151258?
You can request a quote for A3565/0151258 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3565/0151258?
Yes, KEHONG BIO provides custom synthesis services for A3565/0151258 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.