![5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one structure](/static/products/3476/34763-36-5.webp)
5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one
TL;DR: 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one (CAS 34763-36-5) is a chemical compound with molecular formula C10H9N3O4 and molecular weight 235.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(4-nitrophenyl)ethyl]-3H-1,3,4-oxadiazol-2-one
Also Known As: 5-[2-(4-nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one, 5-(4-Nitrophenethyl)-1,3,4-oxadiazol-2(3H)-one, 5-[2-(4-nitrophenyl)ethyl]-3H-1,3,4-oxadiazol-2-one, 5-(4-nitro-phenethyl)-3H-[1,3,4]oxadiazol-2-one
| Molecular Formula | C10H9N3O4 |
|---|---|
| Molecular Weight | 235.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.05931 |
| Heavy Atoms | 17 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 34763-36-5 |
|---|---|
| SMILES | C1=CC(=CC=C1CCC2=NNC(=O)O2)[N+](=O)[O-] |
| InChIKey | LLNLGLNMGYSBMA-UHFFFAOYSA-N |
Product Overview
5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one (CAS 34763-36-5), with molecular formula C10H9N3O4 and molecular weight 235.06 g/mol. IUPAC: 5-[2-(4-nitrophenyl)ethyl]-3H-1,3,4-oxadiazol-2-one.
Chemical Property Profile of 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one
Property Insights of 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one. Following Lipinski's Rule of Five, 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one has 1 hydrogen bond donor(s) and 5 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 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one?
The CAS number of 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one is 34763-36-5.
What is the molecular formula of 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one?
The molecular formula of 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one is C10H9N3O4.
What is the molecular weight of 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one?
The molecular weight of 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one is 235.06 g/mol.
Where can I buy 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one?
You can request a quote for 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-[2-(4-Nitrophenyl)ethyl]-1,3,4-oxadiazol-2(3h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.