![Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate structure](/static/products/757/757228-84-5.png)
Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate
TL;DR: Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate (CAS 757228-84-5) is a chemical compound with molecular formula C14H17N3O2S2 and molecular weight 323.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)carbamate
Also Known As: butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate, butyl N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)carbamate, BUTYL N-[5-(BENZYLSULFANYL)-1,3,4-THIADIAZOL-2-YL]CARBAMATE
| Molecular Formula | C14H17N3O2S2 |
|---|---|
| Molecular Weight | 323.08 g/mol |
| LogP | 4.179 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 323.07623 |
| Heavy Atoms | 21 |
| Complexity | 560.35657 |
Chemical Identifiers
| CAS Number | 757228-84-5 |
|---|---|
| SMILES | CCCCOC(=O)NC1=NN=C(S1)SCC2=CC=CC=C2 |
Product Overview
Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate (CAS 757228-84-5), with molecular formula C14H17N3O2S2 and molecular weight 323.08 g/mol. IUPAC: butyl N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)carbamate.
Chemical Property Profile of Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate
Property Insights of Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate
The XLogP value of 4.179 indicates that Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate. Following Lipinski's Rule of Five, Butyl [5-(benzylsulfanyl)-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 Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate?
The CAS number of Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate is 757228-84-5.
What is the molecular formula of Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate?
The molecular formula of Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate is C14H17N3O2S2.
What is the molecular weight of Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate?
The molecular weight of Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate is 323.08 g/mol.
Where can I buy Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate?
You can request a quote for Butyl [5-(benzylsulfanyl)-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 Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for Butyl [5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.