A3893/0165541
TL;DR: A3893/0165541 (CAS 727366-99-6) is a chemical compound with molecular formula C24H25N5O5 and molecular weight 463.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3'-benzyl-1,3-dimethyl-8'-nitrospiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione
Also Known As: A3893/0165541, 3'-benzyl-1,3-dimethyl-8'-nitrospiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione, 3'-BENZYL-1,5-DIMETHYL-8'-NITRO-1',2',3',4',4'A,6'-HEXAHYDROSPIRO[1,5-DIAZINANE-3,5'-PYRAZINO[1,2-A]QUINOLINE]-2,4,6-TRIONE, 3-benzyl-1',3'-dimethyl-8-nitro-1,2,3,4,4a,6-hexahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(3'H)-trione, 3-benzyl-1',3'-dimethyl-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
| Molecular Formula | C24H25N5O5 |
|---|---|
| Molecular Weight | 463.19 g/mol |
| LogP | 1.8785 |
| Topological Polar Surface Area | 107.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 463.18558 |
| Heavy Atoms | 34 |
| Complexity | 1175.4948 |
Chemical Identifiers
| CAS Number | 727366-99-6 |
|---|---|
| SMILES | CN1C(=O)C2(CC3=C(C=CC(=C3)[N+](=O)[O-])N4C2CN(CC4)CC5=CC=CC=C5)C(=O)N(C1=O)C |
Product Overview
A3893/0165541 (CAS 727366-99-6), with molecular formula C24H25N5O5 and molecular weight 463.19 g/mol. IUPAC: 3'-benzyl-1,3-dimethyl-8'-nitrospiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione.
Chemical Property Profile of A3893/0165541
Property Insights of A3893/0165541
The XLogP value of 1.8785 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3893/0165541. The TPSA of 107.31 Ų falls within the moderate polarity range, balancing permeability and solubility for A3893/0165541. Following Lipinski's Rule of Five, A3893/0165541 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 A3893/0165541?
The CAS number of A3893/0165541 is 727366-99-6.
What is the molecular formula of A3893/0165541?
The molecular formula of A3893/0165541 is C24H25N5O5.
What is the molecular weight of A3893/0165541?
The molecular weight of A3893/0165541 is 463.19 g/mol.
Where can I buy A3893/0165541?
You can request a quote for A3893/0165541 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3893/0165541?
Yes, KEHONG BIO provides custom synthesis services for A3893/0165541 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.