![methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate structure](/static/products/7142/714224-89-2.webp)
methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate
TL;DR: methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate (CAS 714224-89-2) is a chemical compound with molecular formula C11H11N3O3S and molecular weight 265.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate
Also Known As: methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate, methyl (5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl)carbamate, Methyl [5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate, (5-Phenoxymethyl-[1,3,4]thiadiazol-2-yl)-carbamic acid methyl ester, methyl [(2E)-5-(phenoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]carbamate
| Molecular Formula | C11H11N3O3S |
|---|---|
| Molecular Weight | 265.05 g/mol |
| LogP | 2.2954 |
| Topological Polar Surface Area | 73.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 265.05212 |
| Heavy Atoms | 18 |
| Complexity | 515.2618 |
Chemical Identifiers
| CAS Number | 714224-89-2 |
|---|---|
| SMILES | COC(=O)NC1=NN=C(S1)COC2=CC=CC=C2 |
Product Overview
methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate (CAS 714224-89-2), with molecular formula C11H11N3O3S and molecular weight 265.05 g/mol. IUPAC: methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate.
Chemical Property Profile of methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate
Property Insights of methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate
The XLogP value of 2.2954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate. The TPSA of 73.34 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate. Following Lipinski's Rule of Five, methyl N-[5-(phenoxymethyl)-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-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate?
The CAS number of methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate is 714224-89-2.
What is the molecular formula of methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate?
The molecular formula of methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate is C11H11N3O3S.
What is the molecular weight of methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate?
The molecular weight of methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate is 265.05 g/mol.
Where can I buy methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate?
You can request a quote for methyl N-[5-(phenoxymethyl)-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-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.