AB00715284-01
TL;DR: AB00715284-01 (CAS 710987-99-8) is a chemical compound with molecular formula C18H16ClN5O3S and molecular weight 417.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-amino-5-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Also Known As: AB00715284-01, 2-{[4-amino-5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide, 2-((4-amino-5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide, 2-[[4-amino-5-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide, N-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-2-[4-amino-5-(4-chlorophenyl)(1,2,4-tria zol-3-ylthio)]acetamide
| Molecular Formula | C18H16ClN5O3S |
|---|---|
| Molecular Weight | 417.07 g/mol |
| LogP | 2.8143 |
| Topological Polar Surface Area | 104.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.06622 |
| Heavy Atoms | 28 |
| Complexity | 1008.9557 |
Chemical Identifiers
| CAS Number | 710987-99-8 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NN=C(N3N)C4=CC=C(C=C4)Cl |
Product Overview
AB00715284-01 (CAS 710987-99-8), with molecular formula C18H16ClN5O3S and molecular weight 417.07 g/mol. IUPAC: 2-[[4-amino-5-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide.
Chemical Property Profile of AB00715284-01
Property Insights of AB00715284-01
The XLogP value of 2.8143 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00715284-01. The TPSA of 104.29 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00715284-01. Following Lipinski's Rule of Five, AB00715284-01 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 AB00715284-01?
The CAS number of AB00715284-01 is 710987-99-8.
What is the molecular formula of AB00715284-01?
The molecular formula of AB00715284-01 is C18H16ClN5O3S.
What is the molecular weight of AB00715284-01?
The molecular weight of AB00715284-01 is 417.07 g/mol.
Where can I buy AB00715284-01?
You can request a quote for AB00715284-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00715284-01?
Yes, KEHONG BIO provides custom synthesis services for AB00715284-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.