AB00678876-01
TL;DR: AB00678876-01 (CAS 891130-79-3) is a chemical compound with molecular formula C19H23N3O7 and molecular weight 405.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(3,4,5-triethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2,3-dihydro-1,4-dioxine-5-carboxamide
Also Known As: AB00678876-01, AB00678876-04, F2517-0200, N-(5-(3,4,5-triethoxyphenyl)-1,3,4-oxadiazol-2-yl)-5,6-dihydro-1,4-dioxine-2-carboxamide, N-[5-(3,4,5-triethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2,3-dihydro-1,4-dioxine-5-carboxamide
| Molecular Formula | C19H23N3O7 |
|---|---|
| Molecular Weight | 405.15 g/mol |
| LogP | 2.7594 |
| Topological Polar Surface Area | 114.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 405.1536 |
| Heavy Atoms | 29 |
| Complexity | 851.43286 |
Chemical Identifiers
| CAS Number | 891130-79-3 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1OCC)OCC)C2=NN=C(O2)NC(=O)C3=COCCO3 |
Product Overview
AB00678876-01 (CAS 891130-79-3), with molecular formula C19H23N3O7 and molecular weight 405.15 g/mol. IUPAC: N-[5-(3,4,5-triethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2,3-dihydro-1,4-dioxine-5-carboxamide.
Chemical Property Profile of AB00678876-01
Property Insights of AB00678876-01
The XLogP value of 2.7594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00678876-01. The TPSA of 114.17 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00678876-01. Following Lipinski's Rule of Five, AB00678876-01 has 1 hydrogen bond donor(s) and 9 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 AB00678876-01?
The CAS number of AB00678876-01 is 891130-79-3.
What is the molecular formula of AB00678876-01?
The molecular formula of AB00678876-01 is C19H23N3O7.
What is the molecular weight of AB00678876-01?
The molecular weight of AB00678876-01 is 405.15 g/mol.
Where can I buy AB00678876-01?
You can request a quote for AB00678876-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00678876-01?
Yes, KEHONG BIO provides custom synthesis services for AB00678876-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.