1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester)
TL;DR: 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester) (CAS 54014-03-8) is a chemical compound with molecular formula C10H9N3O3 and molecular weight 219.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-phenyl-1,3,4-oxadiazol-2-yl)methyl carbamate
Also Known As: 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester), 5-Phenyl-1,3,4-oxadiazole-2-methanol carbamate (ester), Aminocarbonyloxy-2-methyl-5-phenyl-1,3,4-oxadiazole, (5-phenyl-1,3,4-oxadiazol-2-yl)methyl carbamate, RefChem:216987
| Molecular Formula | C10H9N3O3 |
|---|---|
| Molecular Weight | 219.06 g/mol |
| LogP | 1.3319 |
| Topological Polar Surface Area | 91.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 219.06439 |
| Heavy Atoms | 16 |
| Complexity | 481.0643 |
Chemical Identifiers
| CAS Number | 54014-03-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN=C(O2)COC(=O)N |
Product Overview
1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester) (CAS 54014-03-8), with molecular formula C10H9N3O3 and molecular weight 219.06 g/mol. IUPAC: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl carbamate.
Chemical Property Profile of 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester)
Property Insights of 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester)
The XLogP value of 1.3319 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester). The TPSA of 91.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester). Following Lipinski's Rule of Five, 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester) 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 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester)?
The CAS number of 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester) is 54014-03-8.
What is the molecular formula of 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester)?
The molecular formula of 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester) is C10H9N3O3.
What is the molecular weight of 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester)?
The molecular weight of 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester) is 219.06 g/mol.
Where can I buy 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester)?
You can request a quote for 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester)?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Oxadiazole-2-methanol, 5-phenyl-, carbamate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.