AB00678941-01
TL;DR: AB00678941-01 (CAS 891141-30-3) is a chemical compound with molecular formula C13H9Cl2N3O4 and molecular weight 341.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]-2,3-dihydro-1,4-dioxine-5-carboxamide
Also Known As: AB00678941-01, F2518-0127, N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]-5,6-dihydro-1,4-dioxine-2-carboxamide, N-(5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl)-5,6-dihydro-1,4-dioxine-2-carboxamide, N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]-2,3-dihydro-1,4-dioxine-5-carboxamide
| Molecular Formula | C13H9Cl2N3O4 |
|---|---|
| Molecular Weight | 341.00 g/mol |
| LogP | 2.8701 |
| Topological Polar Surface Area | 86.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.997 |
| Heavy Atoms | 22 |
| Complexity | 744.6365 |
Chemical Identifiers
| CAS Number | 891141-30-3 |
|---|---|
| SMILES | C1COC(=CO1)C(=O)NC2=NN=C(O2)C3=C(C=CC(=C3)Cl)Cl |
Product Overview
AB00678941-01 (CAS 891141-30-3), with molecular formula C13H9Cl2N3O4 and molecular weight 341.00 g/mol. IUPAC: N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]-2,3-dihydro-1,4-dioxine-5-carboxamide.
Chemical Property Profile of AB00678941-01
Property Insights of AB00678941-01
The XLogP value of 2.8701 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00678941-01. The TPSA of 86.48 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00678941-01. Following Lipinski's Rule of Five, AB00678941-01 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 AB00678941-01?
The CAS number of AB00678941-01 is 891141-30-3.
What is the molecular formula of AB00678941-01?
The molecular formula of AB00678941-01 is C13H9Cl2N3O4.
What is the molecular weight of AB00678941-01?
The molecular weight of AB00678941-01 is 341.00 g/mol.
Where can I buy AB00678941-01?
You can request a quote for AB00678941-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00678941-01?
Yes, KEHONG BIO provides custom synthesis services for AB00678941-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.