methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate
TL;DR: methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate (CAS 714946-57-3) is a chemical compound with molecular formula C8H7N3O3S and molecular weight 225.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate
Also Known As: methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate, methyl (5-(furan-2-yl)-1,3,4-thiadiazol-2-yl)carbamate, Methyl [5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate, (5-Furan-2-yl-[1,3,4]thiadiazol-2-yl)-carbamic acid methyl ester, methyl [(2Z)-5-(furan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]carbamate
| Molecular Formula | C8H7N3O3S |
|---|---|
| Molecular Weight | 225.02 g/mol |
| LogP | 1.9764 |
| Topological Polar Surface Area | 77.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.02081 |
| Heavy Atoms | 15 |
| Complexity | 451.40735 |
Chemical Identifiers
| CAS Number | 714946-57-3 |
|---|---|
| SMILES | COC(=O)NC1=NN=C(S1)C2=CC=CO2 |
Product Overview
methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate (CAS 714946-57-3), with molecular formula C8H7N3O3S and molecular weight 225.02 g/mol. IUPAC: methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate.
Chemical Property Profile of methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate
Property Insights of methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate
The XLogP value of 1.9764 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate. The TPSA of 77.25 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate. Following Lipinski's Rule of Five, methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate has 1 hydrogen bond donor(s) and 6 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 methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate?
The CAS number of methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate is 714946-57-3.
What is the molecular formula of methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate?
The molecular formula of methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate is C8H7N3O3S.
What is the molecular weight of methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate?
The molecular weight of methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate is 225.02 g/mol.
Where can I buy methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate?
You can request a quote for methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.