Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate
TL;DR: Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate (CAS 32551-40-9) is a chemical compound with molecular formula C11H11N3O3 and molecular weight 233.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamate
Also Known As: Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate, benzyl N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamate, benzyl (4-methyl-1,2,5-oxadiazol-3-yl)carbamate, 3-FURAZANCARBAMIC ACID, 4-METHYL-, BENZYL ESTER, CARBAMIC ACID, (METHYLFURAZANYL)-, PHENYLMETHYL ESTER
| Molecular Formula | C11H11N3O3 |
|---|---|
| Molecular Weight | 233.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 77.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.08005 |
| Heavy Atoms | 17 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 32551-40-9 |
|---|---|
| SMILES | CC1=NON=C1NC(=O)OCC2=CC=CC=C2 |
| InChIKey | BUCFPEPEOMXHDD-UHFFFAOYSA-N |
Product Overview
Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate (CAS 32551-40-9), with molecular formula C11H11N3O3 and molecular weight 233.08 g/mol. IUPAC: benzyl N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamate.
Chemical Property Profile of Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate
Property Insights of Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate. The TPSA of 77.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate. Following Lipinski's Rule of Five, Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate 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 Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate?
The CAS number of Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate is 32551-40-9.
What is the molecular formula of Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate?
The molecular formula of Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate is C11H11N3O3.
What is the molecular weight of Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate?
The molecular weight of Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate is 233.08 g/mol.
Where can I buy Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate?
You can request a quote for Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 4-methyl-1,2,5-oxadiazol-3-ylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.