AB00677669-01
TL;DR: AB00677669-01 (CAS 872695-44-8) is a chemical compound with molecular formula C20H15N3O5S and molecular weight 409.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]sulfanylacetamide
Also Known As: AB00677669-01, F1899-1400, N-(2H-1,3-benzodioxol-5-yl)-2-{[6-(2H-1,3-benzodioxol-5-yl)pyridazin-3-yl]sulfanyl}acetamide, N-(1,3-benzodioxol-5-yl)-2-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]sulfanylacetamide, N-(benzo[d][1,3]dioxol-5-yl)-2-((6-(benzo[d][1,3]dioxol-5-yl)pyridazin-3-yl)thio)acetamide
| Molecular Formula | C20H15N3O5S |
|---|---|
| Molecular Weight | 409.07 g/mol |
| LogP | 3.3318 |
| Topological Polar Surface Area | 91.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.07324 |
| Heavy Atoms | 29 |
| Complexity | 1074.2119 |
Chemical Identifiers
| CAS Number | 872695-44-8 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C3=NN=C(C=C3)SCC(=O)NC4=CC5=C(C=C4)OCO5 |
Product Overview
AB00677669-01 (CAS 872695-44-8), with molecular formula C20H15N3O5S and molecular weight 409.07 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]sulfanylacetamide.
Chemical Property Profile of AB00677669-01
Property Insights of AB00677669-01
The XLogP value of 3.3318 indicates that AB00677669-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.8 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00677669-01. Following Lipinski's Rule of Five, AB00677669-01 has 1 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 AB00677669-01?
The CAS number of AB00677669-01 is 872695-44-8.
What is the molecular formula of AB00677669-01?
The molecular formula of AB00677669-01 is C20H15N3O5S.
What is the molecular weight of AB00677669-01?
The molecular weight of AB00677669-01 is 409.07 g/mol.
Where can I buy AB00677669-01?
You can request a quote for AB00677669-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00677669-01?
Yes, KEHONG BIO provides custom synthesis services for AB00677669-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.