F1821-0816
TL;DR: F1821-0816 (CAS 868677-70-7) is a chemical compound with molecular formula C19H17N3O6S and molecular weight 415.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(benzenesulfonyl)-N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]propanamide
Also Known As: F1821-0816, 3-(benzenesulfonyl)-N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]propanamide, N-(5-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-1,3,4-oxadiazol-2-yl)-3-(phenylsulfonyl)propanamide
| Molecular Formula | C19H17N3O6S |
|---|---|
| Molecular Weight | 415.08 g/mol |
| LogP | 2.3103 |
| Topological Polar Surface Area | 120.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.0838 |
| Heavy Atoms | 29 |
| Complexity | 1127.8561 |
Chemical Identifiers
| CAS Number | 868677-70-7 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)NC(=O)CCS(=O)(=O)C4=CC=CC=C4 |
Product Overview
F1821-0816 (CAS 868677-70-7), with molecular formula C19H17N3O6S and molecular weight 415.08 g/mol. IUPAC: 3-(benzenesulfonyl)-N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]propanamide.
Chemical Property Profile of F1821-0816
Property Insights of F1821-0816
The XLogP value of 2.3103 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1821-0816. The TPSA of 120.62 Ų falls within the moderate polarity range, balancing permeability and solubility for F1821-0816. Following Lipinski's Rule of Five, F1821-0816 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 F1821-0816?
The CAS number of F1821-0816 is 868677-70-7.
What is the molecular formula of F1821-0816?
The molecular formula of F1821-0816 is C19H17N3O6S.
What is the molecular weight of F1821-0816?
The molecular weight of F1821-0816 is 415.08 g/mol.
Where can I buy F1821-0816?
You can request a quote for F1821-0816 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1821-0816?
Yes, KEHONG BIO provides custom synthesis services for F1821-0816 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.