AB00684585-01
TL;DR: AB00684585-01 (CAS 851095-39-1) is a chemical compound with molecular formula C15H11N3O5 and molecular weight 313.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Also Known As: AB00684585-01, F0608-0467, N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide, N-(5-(furan-2-yl)-1,3,4-oxadiazol-2-yl)-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxamide, N-[5-(2-furyl)-1,3,4-oxadiazol-2-yl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide
| Molecular Formula | C15H11N3O5 |
|---|---|
| Molecular Weight | 313.07 g/mol |
| LogP | 2.3531 |
| Topological Polar Surface Area | 99.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.0699 |
| Heavy Atoms | 23 |
| Complexity | 840.6817 |
Chemical Identifiers
| CAS Number | 851095-39-1 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C(=O)NC3=NN=C(O3)C4=CC=CO4 |
Product Overview
AB00684585-01 (CAS 851095-39-1), with molecular formula C15H11N3O5 and molecular weight 313.07 g/mol. IUPAC: N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide.
Chemical Property Profile of AB00684585-01
Property Insights of AB00684585-01
The XLogP value of 2.3531 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00684585-01. The TPSA of 99.62 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00684585-01. Following Lipinski's Rule of Five, AB00684585-01 has 1 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 AB00684585-01?
The CAS number of AB00684585-01 is 851095-39-1.
What is the molecular formula of AB00684585-01?
The molecular formula of AB00684585-01 is C15H11N3O5.
What is the molecular weight of AB00684585-01?
The molecular weight of AB00684585-01 is 313.07 g/mol.
Where can I buy AB00684585-01?
You can request a quote for AB00684585-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00684585-01?
Yes, KEHONG BIO provides custom synthesis services for AB00684585-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.