AB00865706-06
TL;DR: AB00865706-06 (CAS 869076-80-2) is a chemical compound with molecular formula C16H20ClN5O4S and molecular weight 413.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-5-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-1,3-dimethylpyrimidine-2,4-dione
Also Known As: AB00865706-06, F1859-0044, 6-amino-5-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-1,3-dimethylpyrimidine-2,4-dione, 6-amino-5-((4-(3-chlorophenyl)piperazin-1-yl)sulfonyl)-1,3-dimethylpyrimidine-2,4(1H,3H)-dione, 6-amino-5-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}-1,3-dimethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
| Molecular Formula | C16H20ClN5O4S |
|---|---|
| Molecular Weight | 413.09 g/mol |
| LogP | -0.1695 |
| Topological Polar Surface Area | 110.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 413.09244 |
| Heavy Atoms | 27 |
| Complexity | 1100.7693 |
Chemical Identifiers
| CAS Number | 869076-80-2 |
|---|---|
| SMILES | CN1C(=C(C(=O)N(C1=O)C)S(=O)(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)N |
Product Overview
AB00865706-06 (CAS 869076-80-2), with molecular formula C16H20ClN5O4S and molecular weight 413.09 g/mol. IUPAC: 6-amino-5-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-1,3-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of AB00865706-06
Property Insights of AB00865706-06
The XLogP value of -0.1695 indicates that AB00865706-06 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.64 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00865706-06. Following Lipinski's Rule of Five, AB00865706-06 has 1 hydrogen bond donor(s) and 6 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 AB00865706-06?
The CAS number of AB00865706-06 is 869076-80-2.
What is the molecular formula of AB00865706-06?
The molecular formula of AB00865706-06 is C16H20ClN5O4S.
What is the molecular weight of AB00865706-06?
The molecular weight of AB00865706-06 is 413.09 g/mol.
Where can I buy AB00865706-06?
You can request a quote for AB00865706-06 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00865706-06?
Yes, KEHONG BIO provides custom synthesis services for AB00865706-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.