AB00676368-01
TL;DR: AB00676368-01 (CAS 869067-52-7) is a chemical compound with molecular formula C12H19N5O2S and molecular weight 297.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-6-methyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-1,2,4-triazin-5-one
Also Known As: AB00676368-01, F1847-0014, 4-amino-6-methyl-3-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-4,5-dihydro-1,2,4-triazin-5-one, 4-amino-6-methyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-1,2,4-triazin-5-one, 4-amino-6-methyl-3-((2-(4-methylpiperidin-1-yl)-2-oxoethyl)thio)-1,2,4-triazin-5(4H)-one
| Molecular Formula | C12H19N5O2S |
|---|---|
| Molecular Weight | 297.13 g/mol |
| LogP | 0.01112 |
| Topological Polar Surface Area | 94.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.12595 |
| Heavy Atoms | 20 |
| Complexity | 551.2689 |
Chemical Identifiers
| CAS Number | 869067-52-7 |
|---|---|
| SMILES | CC1CCN(CC1)C(=O)CSC2=NN=C(C(=O)N2N)C |
Product Overview
AB00676368-01 (CAS 869067-52-7), with molecular formula C12H19N5O2S and molecular weight 297.13 g/mol. IUPAC: 4-amino-6-methyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-1,2,4-triazin-5-one.
Chemical Property Profile of AB00676368-01
Property Insights of AB00676368-01
The XLogP value of 0.01112 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00676368-01. The TPSA of 94.11 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00676368-01. Following Lipinski's Rule of Five, AB00676368-01 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 AB00676368-01?
The CAS number of AB00676368-01 is 869067-52-7.
What is the molecular formula of AB00676368-01?
The molecular formula of AB00676368-01 is C12H19N5O2S.
What is the molecular weight of AB00676368-01?
The molecular weight of AB00676368-01 is 297.13 g/mol.
Where can I buy AB00676368-01?
You can request a quote for AB00676368-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00676368-01?
Yes, KEHONG BIO provides custom synthesis services for AB00676368-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.