8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine
TL;DR: 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine (CAS 78534-70-0) is a chemical compound with molecular formula C20H24N8OS and molecular weight 424.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-oxo-1,4-thiazinan-4-yl)-N-phenyl-2-piperazin-1-ylpyrimido[5,4-d]pyrimidin-8-amine
Also Known As: 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine, N-Phenyl-6-(1-piperazinyl)-8-(4-thiomorpholinyl)pyrimido(5,4-d)pyrimidin-4-amine S-oxide, Pyrimido(5,4-d)pyrimidin-4-amine, N-phenyl-6-(1-piperazinyl)-8-(4-thiomorpholinyl)-, S-oxide, 4-(1-oxo-1,4-thiazinan-4-yl)-N-phenyl-2-piperazin-1-ylpyrimido[5,4-d]pyrimidin-8-amine, 8-(1-oxo-1,4-thiazinan-4-yl)-N-phenyl-6-piperazin-1-ylpyrimido[6,5-e]pyrimidin-4-amine
| Molecular Formula | C20H24N8OS |
|---|---|
| Molecular Weight | 424.18 g/mol |
| LogP | 1.1417 |
| Topological Polar Surface Area | 99.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 424.17938 |
| Heavy Atoms | 30 |
| Complexity | 1047.3607 |
Chemical Identifiers
| CAS Number | 78534-70-0 |
|---|---|
| SMILES | C1CN(CCN1)C2=NC3=C(C(=N2)N4CCS(=O)CC4)N=CN=C3NC5=CC=CC=C5 |
Product Overview
8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine (CAS 78534-70-0), with molecular formula C20H24N8OS and molecular weight 424.18 g/mol. IUPAC: 4-(1-oxo-1,4-thiazinan-4-yl)-N-phenyl-2-piperazin-1-ylpyrimido[5,4-d]pyrimidin-8-amine.
Chemical Property Profile of 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine
Property Insights of 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine
The XLogP value of 1.1417 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine. The TPSA of 99.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine. Following Lipinski's Rule of Five, 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine has 2 hydrogen bond donor(s) and 9 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 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine?
The CAS number of 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine is 78534-70-0.
What is the molecular formula of 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine?
The molecular formula of 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine is C20H24N8OS.
What is the molecular weight of 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine?
The molecular weight of 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine is 424.18 g/mol.
Where can I buy 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine?
You can request a quote for 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 8-Anilino-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido(5,4-d)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.