AB00601066-06
TL;DR: AB00601066-06 (CAS 852167-93-2) is a chemical compound with molecular formula C18H24N6O5S and molecular weight 436.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(1,3,7-trimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl)sulfanylacetyl]piperazine-1-carboxylate
Also Known As: AB00601066-06, F0654-0019, ethyl 4-(2-((2,6,8-trimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)thio)acetyl)piperazine-1-carboxylate, ethyl 4-[2-({2,6,8-trimethyl-5,7-dioxo-5H,6H,7H,8H-[1,3]diazino[4,5-d]pyrimidin-4-yl}sulfanyl)acetyl]piperazine-1-carboxylate, ethyl 4-[2-(1,3,7-trimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl)sulfanylacetyl]piperazine-1-carboxylate
| Molecular Formula | C18H24N6O5S |
|---|---|
| Molecular Weight | 436.15 g/mol |
| LogP | -0.27158 |
| Topological Polar Surface Area | 119.63 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.1529 |
| Heavy Atoms | 30 |
| Complexity | 1102.9097 |
Chemical Identifiers
| CAS Number | 852167-93-2 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C |
Product Overview
AB00601066-06 (CAS 852167-93-2), with molecular formula C18H24N6O5S and molecular weight 436.15 g/mol. IUPAC: ethyl 4-[2-(1,3,7-trimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl)sulfanylacetyl]piperazine-1-carboxylate.
Chemical Property Profile of AB00601066-06
Property Insights of AB00601066-06
The XLogP value of -0.27158 indicates that AB00601066-06 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.63 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00601066-06. Following Lipinski's Rule of Five, AB00601066-06 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 AB00601066-06?
The CAS number of AB00601066-06 is 852167-93-2.
What is the molecular formula of AB00601066-06?
The molecular formula of AB00601066-06 is C18H24N6O5S.
What is the molecular weight of AB00601066-06?
The molecular weight of AB00601066-06 is 436.15 g/mol.
Where can I buy AB00601066-06?
You can request a quote for AB00601066-06 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00601066-06?
Yes, KEHONG BIO provides custom synthesis services for AB00601066-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.