AB00676381-01
TL;DR: AB00676381-01 (CAS 869067-69-6) is a chemical compound with molecular formula C13H14ClN5O3S and molecular weight 355.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)sulfanyl]-N-(5-chloro-2-methoxyphenyl)acetamide
Also Known As: AB00676381-01, 2-((4-amino-6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)thio)-N-(5-chloro-2-methoxyphenyl)acetamide, F1847-0037, 2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)sulfanyl]-N-(5-chloro-2-methoxyphenyl)acetamide, 2-[(4-amino-6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)sulfanyl]-N-(5-chloro-2-methoxyphenyl)acetamide
| Molecular Formula | C13H14ClN5O3S |
|---|---|
| Molecular Weight | 355.05 g/mol |
| LogP | 1.05332 |
| Topological Polar Surface Area | 112.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 355.0506 |
| Heavy Atoms | 23 |
| Complexity | 795.66486 |
Chemical Identifiers
| CAS Number | 869067-69-6 |
|---|---|
| SMILES | CC1=NN=C(N(C1=O)N)SCC(=O)NC2=C(C=CC(=C2)Cl)OC |
Product Overview
AB00676381-01 (CAS 869067-69-6), with molecular formula C13H14ClN5O3S and molecular weight 355.05 g/mol. IUPAC: 2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)sulfanyl]-N-(5-chloro-2-methoxyphenyl)acetamide.
Chemical Property Profile of AB00676381-01
Property Insights of AB00676381-01
The XLogP value of 1.05332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00676381-01. The TPSA of 112.13 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00676381-01. Following Lipinski's Rule of Five, AB00676381-01 has 2 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 AB00676381-01?
The CAS number of AB00676381-01 is 869067-69-6.
What is the molecular formula of AB00676381-01?
The molecular formula of AB00676381-01 is C13H14ClN5O3S.
What is the molecular weight of AB00676381-01?
The molecular weight of AB00676381-01 is 355.05 g/mol.
Where can I buy AB00676381-01?
You can request a quote for AB00676381-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00676381-01?
Yes, KEHONG BIO provides custom synthesis services for AB00676381-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.